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· · COA & SDS available for every product · Same-day shipping on in-stock items 1,1-Diphenyl-2-thiourea - ≥95% , CAS No.3898-08-6
Synonyms
NSC49187 | NSC-49187 | EINECS 223-448-0 | MFCD00059151 | D89743 | DTXSID6063228 | HMS1679A09 | STL089891 | Urea, 1,1-diphenyl-2-thio- | Z87002412 | MPJ2UNH7EF | Thiourea,N-diphenyl- | HMS2718G03 | SCHEMBL81706 | AI3-24939 | D0918 | EN300-18676 | SB80163 |
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Why this grade ≥95% 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.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
NSC49187 | NSC-49187 | EINECS 223-448-0 | MFCD00059151 | D89743 | DTXSID6063228 | HMS1679A09 | STL089891 | Urea, 1, 1-diphenyl-2-thio- | Z87002412 | MPJ2UNH7EF | Thiourea, N-diphenyl- | HMS2718G03 | SCHEMBL81706 | AI3-24939 | D0918 | EN300-18676 | SB80163 |
Specifications & Purity
≥95%
Names and Identifiers Pubchem Sid 488194209 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488194209 Canonical Smiles C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=S)N IUPAC Name 1,1-diphenylthiourea InChIKey FPZXQVCYHDMIIA-UHFFFAOYSA-N INCHI 1S/C13H12N2S/c14-13(16)15(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,14,16) Isomeric SMILES C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=S)N RTECS YT2100000 Molecular Weight 228.31 Beilstein 12(3)898 Reaxy-Rn 2368120 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2368120&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 Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass N-phenylthioureas Intermediate Tree Nodes Not available Direct Parent N-phenylthioureas Alternative Parents Thioureas Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents N-phenylthiourea - Thiourea - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound Description This 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 Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 228.310 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 2 Exact Mass 228.072 Da Monoisotopic Mass 228.072 Da Topological Polar Surface Area 61.400 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 212.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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