N,N′-Diphenylthiourea - ≥98% , CAS No.102-08-9

CAS: 102-08-9 Cat. No.: D106094 Peso molecular: 228.31 Beilstein Registry Number: 644277 Número EC: 203-004-2
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
1,3-Diphenylthiourea | 1,3-Diphenyl-thiourea | NCGC00091646-01 | NSC28134 | NSC-28134 | DFT | Diphenylthioharnstoff | Rhenocure CA | Vulkacit CA | 1,3-diphenyl thiourea | N,N'-Diphenylsulfourea | SR-01000398108 | 1,3-Diphenyl-2-thiourea | SYM-DIPHENYLTHIO
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
25g
D106094-25g
3
9,90US$
100g
D106094-100g
≥10
10,90US$
250g
D106094-250g
1

15,90US$

23,90US$
Guardar 8,00 US$ (33.47%)
500g
D106094-500g
2

26,90US$

40,90US$
Guardar 14,00 US$ (34.23%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

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 15 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
1, 3-Diphenylthiourea | 1, 3-Diphenyl-thiourea | NCGC00091646-01 | NSC28134 | NSC-28134 | DFT | Diphenylthioharnstoff | Rhenocure CA | Vulkacit CA | 1, 3-diphenyl thiourea | N, N'-Diphenylsulfourea | SR-01000398108 | 1, 3-Diphenyl-2-thiourea | SYM-DIPHENYLTHIO
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Pubchem Sid488191188
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488191188
Sonrisas canónicasC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2
IUPAC Name1,3-diphenylthiourea
InChIKeyFCSHMCFRCYZTRQ-UHFFFAOYSA-N
INCHI1S/C13H12N2S/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)
Isómeros SMILES C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2
WGK Alemania 3
RTECS FE1225000
Número ONU 2811
Grupo de embalaje I
Peso molecular 228.31
Beilstein 644277
Reaxy-Rn 644277
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=644277&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
SubclassN-phenylthioureas
Intermediate Tree Nodes Not available
Direct ParentN-phenylthioureas
Alternative Parents Thioureas  Organopnictogen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents N-phenylthiourea - Thiourea - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
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NR1H4 Tclin Bile acid receptor FXR (6228 Activities)
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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
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HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)
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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.

17 results found

Lot NumberCertificate TypeFechaArticulo
G2222319Certificate of AnalysisMay 09, 2026 D106094
G2222320Certificate of AnalysisMay 09, 2026 D106094
G2222321Certificate of AnalysisMay 09, 2026 D106094
G2222326Certificate of AnalysisMay 09, 2026 D106094
A1817125Certificate of AnalysisAug 18, 2025 D106094
J2019222Certificate of AnalysisAug 20, 2024 D106094
J2019223Certificate of AnalysisAug 20, 2024 D106094
J2416412Certificate of AnalysisJul 27, 2024 D106094
J2416411Certificate of AnalysisJul 27, 2024 D106094
J2416410Certificate of AnalysisJul 27, 2024 D106094
J2416409Certificate of AnalysisJul 27, 2024 D106094
J2416408Certificate of AnalysisJul 27, 2024 D106094
G2404116Certificate of AnalysisApr 28, 2024 D106094
G2404117Certificate of AnalysisApr 28, 2024 D106094
G2404115Certificate of AnalysisApr 28, 2024 D106094
B2309205Certificate of AnalysisFeb 11, 2023 D106094
G2222322Certificate of AnalysisJun 11, 2022 D106094

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Propiedades químicas y físicas
SolubilidadSolubility in water: Practically insoluble; Soluble in Alcohol,Chloroform,Ether
Punto de fusión (°C)152-155°C
Peso molecular228.310 g/mol
XLogP32.200
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass228.072 Da
Monoisotopic Mass228.072 Da
Topological Polar Surface Area56.200 Ų
Heavy Atom Count16
Formal Charge0
Complexity196.000
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. Chengtang Long, Zhuoyin Peng, Jincheng Huang, Yue Wang, Wen Luo, Yilong Fu, Jianlin Chen, Jian Chen.  (2022)  Enhancement on charge transfer properties of Cu12Sb4S13 quantum dots hole transport materials by surface ligand modulation in perovskite solar cells.  NEW JOURNAL OF CHEMISTRY,  46  (24): (11751-11758).  [PMID:] [10.1039/D2NJ01236G]
2. Wei Wei, Wen Chen, Xizhu Zhao, Zifan Yang, Yueli Liu.  (2021)  Improved open-circuit voltage of CsPbI3 quantum dot solar cells by PMMA interlayer.  JOURNAL OF ALLOYS AND COMPOUNDS,      [PMID:] [10.1016/j.jallcom.2021.161985]
3. Bingxin Xie, Lei Lei, Enyang Liu, Gongxun Bai, Renguang Ye, Shiqing Xu.  (2020)  Blue-LED-excited Ce3+-doped alkaline-earth sulfide luminescent nanocrystals for selective and sensitive Fe3+ ions sensing.  JOURNAL OF LUMINESCENCE,      [PMID:] [10.1016/j.jlumin.2020.117740]
4. Yueli Liu, Xizhu Zhao, Zifan Yang, Qitao Li, Wei Wei, Bin Hu, Wen Chen.  (2020)  Cu12Sb4S13 Quantum Dots with Ligand Exchange as Hole Transport Materials in All-Inorganic Perovskite CsPbI3 Quantum Dot Solar Cells.  ACS Applied Energy Materials,      [PMID:] [10.1021/acsaem.0c00061]
5. Yueli Liu, Haoran Wang, Keqiang Chen, Tingqiang Yang, Shuang Yang, Wen Chen.  (2019)  Acidic Site-Assisted Ammonia Sensing of Novel CuSbS2 Quantum Dots/Reduced Graphene Oxide Composites with an Ultralow Detection Limit at Room Temperature.  ACS Applied Materials & Interfaces,      [PMID:30763058] [10.1021/acsami.8b20830]
6. Liu Yueli, Zhong Qiaohui, Chen Keqiang, Zhou Jing, Yang Xue, Chen Wen.  (2017)  Morphologies controllable synthesis of MoS2 by hot-injection method: from quantum dots to nanosheets.  JOURNAL OF MATERIALS SCIENCE-MATERIALS IN ELECTRONICS,  28  (18): (13633-13637).  [PMID:] [10.1007/s10854-017-7204-z]
7. Weili Dai, Wanyuan Yang, Ya Zhang, Dan Wang, Xubiao Luo, Xinman Tu.  (2017)  Novel isothiouronium ionic liquid as efficient catalysts for the synthesis of cyclic carbonates from CO2 and epoxides.  Journal of CO2 Utilization,      [PMID:] [10.1016/j.jcou.2016.12.010]
8. Xiaopeng Xu, Si Chen, Wei Tang, Yingjun Qu, Xu Wang.  (2012)  Synthesis and application of uracil derivatives as novel thermal stabilizers for rigid poly(vinyl chloride).  POLYMER DEGRADATION AND STABILITY,      [PMID:] [10.1016/j.polymdegradstab.2012.11.008]
9. Yuan Zhang, Dong Wang, Gaili Liu, Kun Wang, Shaomin Shuang, Chuan Dong.  (2025)  A novel CuO nanoparticle loaded DMSN@MnO2 nanozyme as an optical platform for 2-mercaptobenzothiazole assays and biotoxicity mitigation.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.159363]
10. Lin Liu, Junpeng Shi, Jinyuan Wang, Linping He, Yan Gao, Peng Lin, Yutong Han, Ping'an Ma, Jun Lin, Yun Zhang.  (2024)  Biodegradable Persistent Luminescence Nanoparticles as Pyroptosis Inducer for High-Efficiency Tumor Immunotherapy.  Advanced Science,      [PMID:39158490] [10.1002/advs.202406340]
11. Keqiang Chen, Dan Liu, Weiqi Lu, Kaihuai Zhuo, Guogang Li.  (2024)  Surface and Interface Engineering for Highly Stable CsPbBr3/ZnS Core/Shell Nanocrystals.  INORGANIC CHEMISTRY,      [PMID:38232766] [10.1021/acs.inorgchem.3c04210]
12. Hongge Cao, Yuhang Wu, Ruicai Gao, Peijie He, Qiang Wu, Jixiang Cui, Longyan Gu, Tuo Cai, Ping Peng, Yan Lei, Yuan Lin, Zhi Zheng.  (2025)  A benchtop route of doping Bi into Ag2S collodial quantum dots for eco-friendly solar cells.  JOURNAL OF POWER SOURCES,      [PMID:] [10.1016/j.jpowsour.2025.236196]
13. Pengfei Yang, Jie Zhang, Guanglei Ma, Songsong Zhi, Yi Chang, Lina Ding, Xiaoming Ma, Yuming Guo.  (2025)  Multifunctional self-cascade nanoplatform for efficient immunotherapy through synergizing pyroptosis and self-augmented activation of cGAS-STING pathway.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:41218499] [10.1016/j.jcis.2025.139423]
14. Ning Zhou, Yiheng Shen, Fancheng Kong, Philip C. Y. Chow, Hin-Lap Yip.  (2026)  Isomer-Induced Steric Effects on Coordination Site Modification for Interface Passivation in Perovskite Solar Cells.  Solar RRL,  10  (1): (e202500921).  [PMID:] [10.1002/solr.202500921]
15. Jun-Liang Li, Ke-Lei Zu, Chang-Sheng Shi, Bin Xu, Jian Xu, Yin-Fen Ma, Ji-Xiong Zhao, You-Mei Wang, Hai-Liang Long, Qi Zhan, Feng Qiu, Mei Leng, Yong-biao Zhao, Zheng-Hong Lu.  (2026)  Photomultiplication Enables Efficient NIR Quantum Dot Organic Upconversion Devices.  ACS Photonics,      [PMID:] [10.1021/acsphotonics.5c02809]
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