N-(2-Chloro-5-(trifluoromethyl)phenyl)hydrazinecarbothioamide

Base Information

• Chemical Name: N-(2-Chloro-5-(trifluoromethyl)phenyl)hydrazinecarbothioamide
• CAS No.: 206559-51-5
• Molecular Formula: C8H7ClF3N3S
• Molecular Weight: 269.67
• Hs Code.: 2930909090
• European Community (EC) Number: 671-135-6
• DSSTox Substance ID: DTXSID70353252
• Wikidata: Q82130725
• Mol file: 206559-51-5.mol

Synonyms:206559-51-5;4-[2-Chloro-5-(trifluoromethyl)phenyl]-3-thiosemicarbazide;N-(2-Chloro-5-(trifluoromethyl)phenyl)hydrazinecarbothioamide;1-amino-3-[2-chloro-5-(trifluoromethyl)phenyl]thiourea;3-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]thiourea;C8H7ClF3N3S;N-[2-Chloro-5-(trifluoromethyl)phenyl]hydrazinecarbothioamide;Maybridge1_001008;SCHEMBL5435221;HMS544F18;DTXSID70353252;MXGYRNPXMHSZKJ-UHFFFAOYSA-N;BTB 05098;CCG-48575;MFCD00041274;AKOS000122357;CS-0220984;FT-0682044;EN300-08072;A913164;SR-01000044066;SR-01000044066-1;SR-01000044066-2;BRD-K29672279-001-01-0;Z56921808

Chemical Property of N-(2-Chloro-5-(trifluoromethyl)phenyl)hydrazinecarbothioamide

Chemical Property:

• Vapor Pressure: 0.000704mmHg at 25°C
• Melting Point: 156-158°C
• Boiling Point: 307.9°C at 760 mmHg
• Flash Point: 140°C
• PSA: 82.17000
• Density: 1.569g/cm³
• LogP: 3.68310
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 269.0001306
• Heavy Atom Count: 16
• Complexity: 261

Purity/Quality:

98%min ^*data from raw suppliers

4-[2-Chloro-5-(trifluoromethyl)phenyl]-3-thiosemicarbazide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C(F)(F)F)NC(=S)NN)Cl