m-Dinitrobenzene - ≥99%(HPLC), for HPLC derivatization, for the detection of steroids , CAS No.99-65-0

CAS: 99-65-0 Cat. No.: D108543 Peso molecular: 168.11 Beilstein Registry Number: 1105654 Número EC: 202-776-8
Disponible para pedir
GRADE & PURITY ≥99%(HPLC) for HPLC derivatization, for the detection of steroids
Synonyms
D87507 | 1,3-Dinitrobenzene, 97% anhydrous basis | 1,3 Dinitrobenzene | 1,3-Dinitrobenzene 10 microg/mL in Methanol | NSC 7189 | CCRIS 1802 | 1,3-Dinitrobenzene | 1,3-Dinitro-benzene | 1,3-DINITROBENZENE [HSDB] | EN300-19976 | ghl.PD_Mitscher_leg0.916 | C
Storage
Room temperature
Shipped In
FedEx DG Service
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Size
Estado
Price
Qty
25g
D108543-25g
2
29,90US$
50g
D108543-50g
2
45,90US$
250g
D108543-250g
2
179,90US$
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Why this grade

≥99%(HPLC), for HPLC derivatization, for the detection of steroids for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 29 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
D87507 | 1, 3-Dinitrobenzene, 97% anhydrous basis | 1, 3 Dinitrobenzene | 1, 3-Dinitrobenzene 10 microg/mL in Methanol | NSC 7189 | CCRIS 1802 | 1, 3-Dinitrobenzene | 1, 3-Dinitro-benzene | 1, 3-DINITROBENZENE [HSDB] | EN300-19976 | ghl.PD_Mitscher_leg0.916 | C
Especificaciones y pureza
≥99%(HPLC), for HPLC derivatization, for the detection of steroids
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
FedEx DG Service
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥99%(HPLC)
Nombres e identificadores
Sonrisas canónicasC1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
IUPAC Name1,3-dinitrobenzene
InChIKeyWDCYWAQPCXBPJA-UHFFFAOYSA-N
INCHI1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H
Isómeros SMILES C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
WGK Alemania 2
RTECS CZ7350000
Número ONU 1597
Grupo de embalaje II
Peso molecular 168.11
Beilstein 1105654
Reaxy-Rn 1105654
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1105654&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassNitrobenzenes
Intermediate Tree Nodes Not available
Direct ParentNitrobenzenes
Alternative Parents Nitroaromatic compounds  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Nitrobenzene - Nitroaromatic compound - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors a small molecule
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
NR3C1 Tclin Glucocorticoid receptor (14987 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Lymphoblastoid cell (5959 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
LMNA Tbio Prelamin-A/C (36751 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PMP22 Tbio Peripheral myelin protein 22 (699 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Salmonella typhimurium (15756 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
lef Anthrax lethal factor (7585 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rorc Nuclear receptor ROR-gamma (89407 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot NumberCertificate TypeFechaArticulo
F2609028Certificate of AnalysisJun 22, 2026 D108543
E2211267Certificate of AnalysisFeb 04, 2026 D108543
E2211271Certificate of AnalysisFeb 04, 2026 D108543
E2211250Certificate of AnalysisMay 06, 2022 D108543
F2417084Certificate of AnalysisMay 06, 2022 D108543
J2227124Certificate of AnalysisMay 06, 2022 D108543
Propiedades químicas y físicas
SensibilidadMoisture sensitive.
Punto de inflamación (°F)302 °F
Punto de inflamación (°C)150 °C
Punto de ebullición (°C)291°C
Punto de fusión (°C)89°C
Peso molecular168.110 g/mol
XLogP31.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass168.017 Da
Monoisotopic Mass168.017 Da
Topological Polar Surface Area91.600 Ų
Heavy Atom Count12
Formal Charge0
Complexity175.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Preguntas frecuentes y artículos
Citations of This Product
Referencias
1. Zhuohua Dai, Guangfa Wang, Fangfang Xiao, Da Lei, Xincun Dou.  (2023)  Amorphous Copper-Based Nanoparticles with Clusterization-Triggered Phosphorescence for Ultrasensing 2,4,6-Trinitrotoluene.  ADVANCED MATERIALS,  35  (24): (2300526).  [PMID:36929680] [10.1002/adma.202300526]
2. Haotian Wu, Guangfa Wang, Zhenzhen Cai, Dezhong Li, Fangfang Xiao, Da Lei, Zhuohua Dai, Xincun Dou.  (2022)  Polyethyleneimine-capped copper nanoclusters for detection and discrimination of 2,4,6-trinitrotoluene and 2,4,6-trinitrophenol.  Analytical Methods,  14  (44): (4485-4494).  [PMID:36317750] [10.1039/D2AY01311H]
3. Lihua Zhu, Huan Zhang, Huaze Zhu, Huan Fu, Anna Kroner, Zhiqing Yang, Hengqiang Ye, Bing Hui Chen, Rafael Luque.  (2022)  Controlling nanostructures of PtNiCo/C trimetallic nanocatalysts and relationship of structure-catalytic performance for selective hydrogenation of nitroarenes.  JOURNAL OF CATALYSIS,      [PMID:] [10.1016/j.jcat.2022.08.012]
4. Chaorui Xue, Qian Zhang, Yang Shen, Shengliang Hu, Qing Chang, Huiqi Wang, Ning Li, Jinlong Yang.  (2022)  Laser thermal synthesis of reduced graphene oxide/CuS nanocomposites for efficient solar-driven water purification.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2022.121168]
5. Hanxing Yang, Zhongguang Ji, Yanbo Zeng, Jian Zhang, Lifen Chen, Hailong Wang, Yiwen Yang, Longhua Guo, Lei Li.  (2022)  Aggregation-induced emission monomer-based fluorescent molecularly imprinted poly(ionic liquid) synthesized by a one-pot method for sensitively detecting 4-nitrophenol.  Analytical Methods,  14  (10): (1023-1030).  [PMID:35188146] [10.1039/D1AY02132J]
6. Wenli Peng, Li Gan, Weihan Li, Shixiong Deng.  (2021)  Carbon Dot Functionalized Papers for the Selective Detection of 2,4,6-Trinitrophenol in Aqueous Solutions.  Advances in Materials Science and Engineering,      [PMID:] [10.1155/2021/4867869]
7. Xiaonan Duan, Jiabin Yin, Mengmeng Huang, Aoxing Feng, Weisong Fu, Huaxiang Chen, Zhenfu Huang, Yagang Ding, Jisong Zhang.  (2021)  Hydrogenation kinetics of m-dinitrobenzene in a continuous micro-packed bed reactor.  CHEMICAL ENGINEERING SCIENCE,      [PMID:] [10.1016/j.ces.2021.117113]
8. Deyi Zhan, Abdul Saeed, Zixuan Li, Chengming Wang, Zhiwu Yu, Junfeng Wang, Nanjing Zhao, Weihong Xu, Jinhuai Liu.  (2020)  Highly fluorescent scandium-tetracarboxylate frameworks: selective detection of nitro-aromatic compounds, sensing mechanism, and their application.  DALTON TRANSACTIONS,  49  (48): (17737-17744).  [PMID:33237063] [10.1039/D0DT03781H]
9. Qian Liu, Feifei Zhao, Bingfeng Shi, Changli Lü.  (2020)  Mussel-inspired polydopamine-encapsulated carbon dots with dual emission for detection of 4-nitrophenol and Fe3+.  LUMINESCENCE,  36  (2): (431-442).  [PMID:33043598] [10.1002/bio.3961]
10. Xinfeng Chen, Congming Sun, Yang Liu, Long Yu, Kui Zhang, Abdullah M. Asiri, Hadi M. Marwani, Hua Tan, Yuejie Ai, Xiangke Wang, Suhua Wang.  (2019)  All-inorganic perovskite quantum dots CsPbX3 (Br/I) for highly sensitive and selective detection of explosive picric acid.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2019.122360]
11. Lamaocao Ma, Hengchang Ma.  (2019)  Synthesis of π-conjugated network polymers based on triphenylamine (TPA) and tetraphenylethylene (TPE) as building blocks via direct Pd-catalyzed reactions and their application in CO2 capture and explosive detection.  RSC Advances,  (32): (18098-18105).  [PMID:35515247] [10.1039/C9RA02469G]
12. Jie Ma, Lei Bian, Lei Zhao, Xiaotong Feng, Lizhi Zhao, Zhaoyan Wang, Qiaosheng Pu.  (2019)  Dialysed caramel as an effective fluorophore for the simultaneous detection of three nitrophenols.  TALANTA,      [PMID:30771918] [10.1016/j.talanta.2019.01.006]
13. Yulian Li, Lingyun Feng, Wei Yan, Irshad Hussain, Li Su, Bien Tan.  (2018)  PVP-templated highly luminescent copper nanoclusters for sensing trinitrophenol and living cell imaging.  Nanoscale,  11  (3): (1286-1294).  [PMID:30603761] [10.1039/C8NR07142J]
14. Ju Yan Jun, Li Na, Liu Shi Gang, Fan Yu Zhu, Ling Yu, Xiao Na, Luo Hong Qun, Li Nian Bing.  (2018)  Green Synthesis of Blue Fluorescent P-doped Carbon Dots for the Selective Determination of Picric Acid in an Aqueous Medium.  ANALYTICAL SCIENCES,  35  (2): (147-152).  [PMID:30249931] [10.2116/analsci.18P372]
15. Wen Jie Zhang, Shi Gang Liu, Lei Han, Yu Ling, Liu Li Liao, Shi Mo, Hong Qun Luo, Nian Bing Li.  (2018)  Copper nanoclusters with strong fluorescence emission as a sensing platform for sensitive and selective detection of picric acid.  Analytical Methods,  10  (35): (4251-4256).  [PMID:] [10.1039/C8AY01357H]
16. Jinxia Xu, Zhangjun Bai, Fanlin Zu, Fanyong Yan, Junfu Wei, Saihui Zhang, Yunmei Luo.  (2018)  A dual spectroscopic fluorescence probe based on carbon dots for detection of 2,4,6-trinitrophenol/Fe (III) ion by fluorescence and frequency doubling scattering spectra and its analytical applications.  SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY,      [PMID:29679931] [10.1016/j.saa.2018.03.080]
17. Na Xiao, Shi Gang Liu, Shi Mo, Na Li, Yan Jun Ju, Yu Ling, Nian Bing Li, Hong Qun Luo.  (2018)  Highly selective detection of p-nitrophenol using fluorescence assay based on boron, nitrogen co-doped carbon dots.  TALANTA,      [PMID:29674031] [10.1016/j.talanta.2018.02.114]
18. Yu Zhu Fan, Ying Zhang, Na Li, Shi Gang Liu, Ting Liu, Nian Bing Li, Hong Qun Luo.  (2016)  A facile synthesis of water-soluble carbon dots as a label-free fluorescent probe for rapid, selective and sensitive detection of picric acid.  SENSORS AND ACTUATORS B-CHEMICAL,      [PMID:] [10.1016/j.snb.2016.09.063]
19. Meng Li Liu, Bin Bin Chen, Ze Xi Liu, Cheng Zhi Huang.  (2016)  Highly selective and sensitive detection of 2,4,6-trinitrophenol by using newly developed blue–green photoluminescent carbon nanodots.  TALANTA,      [PMID:27769497] [10.1016/j.talanta.2016.08.046]
20. Tao Lu, Yuan Yuan, Yan Jiao, Zhining Wen, Lu Wang, Yihuan Zhao, Yuxiang Zhang, Menglong Li, Xuemei Pu, Tao Xu.  (2016)  Simultaneous spectrophotometric quantification of dinitrobenzene isomers in water samples using multivariate calibration methods.  CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS,      [PMID:] [10.1016/j.chemolab.2016.03.022]
21. Bin Bin Chen, Ze Xi Liu, Hong Yan Zou, Cheng Zhi Huang.  (2016)  Highly selective detection of 2,4,6-trinitrophenol by using newly developed terbium-doped blue carbon dots.  ANALYST,  141  (9): (2676-2681).  [PMID:27109163] [10.1039/C5AN02569A]
22. Haiyang Cheng, Weiwei Lin, Xiaoru Li, Chao Zhang, Fengyu Zhao.  (2014)  Selective Hydrogenation of m-Dinitrobenzene to m-Nitroaniline over Ru-SnOx/Al2O3 Catalyst.  Catalysts,  (3): (276-288).  [PMID:] [10.3390/catal4030276]
23. Ruiqi Qiao, Yingxing Li, Rongchao Zhu, Huazangnaowu Bai, Chuanfang Zhao, Baiyi Zu, Zhenzhen Cai.  (2025)  Carbonized polymer dots for discrimination of 2,4,6-trinitrotoluene and 2,4,6-trinitrophenol.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:40112434] [10.1016/j.jhazmat.2025.137944]
24. Yongli Liu, Guobei Ge, Huanjia Liu, Yuxin Wang, Penghui Zhou, Bin Li, Guifen Zhu.  (2024)  Fast and eco-friendly synthesis of carbon dots from pinecone for highly effective detection of 2,4,6-trinitrophenol in environmental samples.  ENVIRONMENTAL TECHNOLOGY,      [PMID:38887014] [10.1080/09593330.2024.2367725]
25. Kefa Sheng, Hongyu Xia, Jianping Ge.  (2024)  Highly dispersed Pd nanoparticles supported by magnetically separable Fe3O4@ SiO2 nanotube for catalytic hydrogenation of nitroaromatics.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:39059282] [10.1016/j.jcis.2024.07.156]
26. Zitao Shen, Zhuo Wang, Pengfei Ye, Lihong Guo, Sheng Peng, Yuefan Liu, Yongsheng Cui, Juan Zheng, Gangfeng Ouyang.  (2025)  Highly hydrophobic calixarene polymers for efficient enrichment of polar nitrobenzene compounds.  TALANTA,      [PMID:39778492] [10.1016/j.talanta.2025.127555]
27. Zhiang Hou, Huachun Lan, Xiaoqiang An, Ruijuan Liu, Lan Yang, Lie Liu, Huijuan Liu, Jiuhui Qu.  (2024)  Nitrogen-doped hierarchical porous carbon with enhanced interfacial affinity for the efficient adsorption of antibiotic micropollutants from water.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2024.155055]
28. Zhijun Li, Mingyang Zhang, Xiuli Dong, Siqi Ji, Lili Zhang, Leipeng Leng, Honghong Li, J. Hugh Horton, Qian Xu, Junfa Zhu.  (2022)  Strong electronic interaction of indium oxide with palladium single atoms induced by quenching toward enhanced hydrogenation of nitrobenzene.  APPLIED CATALYSIS B-ENVIRONMENTAL,      [PMID:] [10.1016/j.apcatb.2022.121462]
29. Yihong Zhou, Yang Xu, Peng Wang, Jing Zhang, Shangxing Chen, Dayong Peng, Zongde Wang, Yuling Yang, Hai Luo, Ji Zhang.  (2025)  Modification of Pickering emulsions using zein-tannic acid particles: enhancement of antioxidant and thermal stability properties of citral.  LWT-FOOD SCIENCE AND TECHNOLOGY,      [PMID:] [10.1016/j.lwt.2025.117761]
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