Dichloran - analytical standard , CAS No.99-30-9

CAS: 99-30-9 Cat. No.: D114706 Peso molecular: 207.01 Beilstein Registry Number: 1459581 Número EC: 202-746-4
Disponible para pedir
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
Caswell No. 311 | MLS002152899 | Batran | Bortran | Botran 45W | CDNA | AL-50 | Botran 75b | GRIMACIT | 2,6-Dichloro-4-nitroaniline, 96% | NCGC00259890-01 | Tox21_202341 | Botran | EINECS 202-746-4 | 1-Amino-2,6-dichloro-4-nitrobenzene | SCHEMBL229362 | 2
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
D114706-250mg
6

153,90US$

178,90US$
Guardar 25,00 US$ (13.97%)
1g
D114706-1g
3
570,90US$
5g
D114706-5g
1
2.282,90US$
25g
D114706-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

7.626,90US$

9.130,90US$
Guardar 1.504,00 US$ (16.47%)
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Why this grade

analytical standard Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal 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.

📚

Literature proof

Cited in 6 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
Caswell No. 311 | MLS002152899 | Batran | Bortran | Botran 45W | CDNA | AL-50 | Botran 75b | GRIMACIT | 2, 6-Dichloro-4-nitroaniline, 96% | NCGC00259890-01 | Tox21_202341 | Botran | EINECS 202-746-4 | 1-Amino-2, 6-dichloro-4-nitrobenzene | SCHEMBL229362 | 2
Especificaciones y pureza
analytical standard
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Grado
Analytical standard
Nombres e identificadores
Sonrisas canónicasC1=C(C=C(C(=C1Cl)N)Cl)[N+](=O)[O-]
IUPAC Name2,6-dichloro-4-nitroaniline
InChIKeyBIXZHMJUSMUDOQ-UHFFFAOYSA-N
INCHI1S/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2
Isómeros SMILES C1=C(C=C(C(=C1Cl)N)Cl)[N+](=O)[O-]
WGK Alemania 3
RTECS BX2975000
Peso molecular 207.01
Beilstein 1459581
Reaxy-Rn 1459581
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1459581&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  Dichlorobenzenes  Aniline and substituted anilines  Aryl chlorides  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Primary amines  Organopnictogen compounds  Organochlorides  Organic zwitterions  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Nitrobenzene - Nitroaromatic compound - 1,3-dichlorobenzene - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic zwitterion - Primary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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 Pesticides
Estructura 3D
Modelo de Estructura Química Interactiva





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MAOB Tclin Monoamine oxidase B (8835 Activities)
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ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
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TP53 Tchem Cellular tumor antigen p53 (48468 Activities)
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GNAS Tbio Guanine nucleotide-binding protein G(s), subunit alpha (103405 Activities)
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SMAD3 Tchem Mothers against decapentaplegic homolog 3 (68039 Activities)
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ampC Beta-lactamase AmpC (62480 Activities)
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Aspergillus parasiticus (296 Activities)
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Penicillium brevicompactum (15 Activities)
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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
Nr1i2 Nuclear receptor subfamily 1 group I member 2 (14 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
L2215922Certificate of AnalysisJun 08, 2026 D114706
J2030051Certificate of AnalysisMar 20, 2026 D114706
J2030050Certificate of AnalysisMar 20, 2026 D114706
J2520171Certificate of AnalysisOct 22, 2025 D114706
K2422366Certificate of AnalysisNov 28, 2024 D114706
A1911051Certificate of AnalysisSep 09, 2022 D114706
Propiedades químicas y físicas
Punto de fusión (°C)190-192°C
Peso molecular207.010 g/mol
XLogP32.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass205.965 Da
Monoisotopic Mass205.965 Da
Topological Polar Surface Area71.800 Ų
Heavy Atom Count12
Formal Charge0
Complexity173.000
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
Citations of This Product
Referencias
1. Zhuojun Yan, Jinni Liu, Congke Miao, Pinjie Su, Guiyue Zheng, Bo Cui, Tongfei Geng, Jiating Fan, Zhiyi Yu, Naishun Bu, Ye Yuan, Lixin Xia.  (2021)  Pyrene-Based Fluorescent Porous Organic Polymers for Recognition and Detection of Pesticides.  MOLECULES,  27  (1): (126).  [PMID:35011357] [10.3390/molecules27010126]
2. Mingyue Wang, Neveen Mohamed Hashem, Hongjuan Zhao, Jian Wang, Yanfeng Sun, Xiaoqing Xiong, Laijiu Zheng, Mamdouh Sofan, Tarek Abou Elmaaty.  (2021)  Effect of the degree of esterification of disperse dyes on the dyeing properties of polyethylene terephthalate in supercritical carbon dioxide.  JOURNAL OF SUPERCRITICAL FLUIDS,      [PMID:] [10.1016/j.supflu.2021.105270]
3. Yuang Zhang, Gagik G. Gurzadyan, Malik Muhammad Umair, Wentao Wang, Rongwen Lu, Shufen Zhang, Bingtao Tang.  (2018)  Ultrafast and efficient photothermal conversion for sunlight-driven thermal-electric system.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2018.03.098]
4. Min Li, Wujun Ma, Liping Zhang, Christiana Agbo, Shaohai Fu.  (2016)  Investigation from Synthesis to Crystal Structure to Application of Ecofriendly Disperse Dyes on One-Step Dyeing of PET Fabric.  ACS Sustainable Chemistry & Engineering,      [PMID:] [10.1021/acssuschemeng.6b02100]
5. Pei Xiu, Bai Jinchuan, Li Yaming, Kong Xiangbo.  (2024)  A Fluorescent Nanoplatform Based on Tb3+@tartric Acid-Functionalized UiO-67-bpy: A New Strategy of Synergistic Sensitization and its Highly Sensitive Performance toward the Detection of Nitenpyram.  Journal of Inorganic and Organometallic Polymers and Materials,      [PMID:] [10.1007/s10904-024-03420-w]
6. Kaixiang Cui, Yong Chen, Keyu Xie, Haonan Peng, Liping Ding, Yu Fang.  (2025)  Nanoconfined Synthesis of CsPbBr3 Quantum Dots: Enhanced Stability, Tunable Luminescence, and Sensitive Sensing Application.  ACS Applied Materials & Interfaces,      [PMID:40111172] [10.1021/acsami.4c22763]
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