4-(4-Phenoxyphenyl)-3-thiosemicarbazide

Base Information

• Chemical Name: 4-(4-Phenoxyphenyl)-3-thiosemicarbazide
• CAS No.: 206761-85-5
• Molecular Formula: C13H13N3OS
• Molecular Weight: 259.33
• Hs Code.: 2930909090
• European Community (EC) Number: 673-729-0
• DSSTox Substance ID: DTXSID40375123
• Wikidata: Q82163657
• Mol file: 206761-85-5.mol

Synonyms:4-(4-Phenoxyphenyl)-3-thiosemicarbazide;206761-85-5;1-amino-3-(4-phenoxyphenyl)thiourea;3-amino-1-(4-phenoxyphenyl)thiourea;N-(4-Phenoxyphenyl)hydrazinecarbothioamide;Oprea1_429706;DTXSID40375123;MFCD00041299;1-azanyl-3-(4-phenoxyphenyl)thiourea;AKOS000349028;BS-22024;CS-0206122;FT-0616667;A814805;SR-01000102631;SR-01000102631-1

Chemical Property of 4-(4-Phenoxyphenyl)-3-thiosemicarbazide

Chemical Property:

• Vapor Pressure: 1.29E-06mmHg at 25°C
• Melting Point: 140 °C (dec.)
• Refractive Index: 1.707
• Boiling Point: 400.3 °C at 760 mmHg
• Flash Point: 195.9 °C
• PSA: 91.40000
• Density: 1.316 g/cm³
• LogP: 3.80320
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 259.07793322
• Heavy Atom Count: 18
• Complexity: 261

Purity/Quality:

99% ^*data from raw suppliers

4-(4-Phenoxyphenyl)-3-thiosemicarbazide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R22:Harmful if swallowed.
• Hazard Codes: R22:Harmful if swallowed.
• Statements: 22
• Safety Statements: 22-36/37

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NN