Basic information
- CAS
1932-36-1- Standard SMILES
S=C(Nc1ccccc1)Nc1ccccc1Cl- InChIKey
GJXBIVMCTDXUKR-UHFFFAOYSA-N- Molecular formula
- C13H11ClN2S
- Average molar mass
- 262.76 g/mol
- Monoisotopic mass
- 262.0331472
Names & identifiers
- Preferred name
- 1-(2-Chlorophenyl)-3-phenyl-2-thiourea
- IUPAC
- 1-(2-chlorophenyl)-3-phenylthiourea
- English name
- 1-(2-Chlorophenyl)-3-phenyl-2-thiourea
- Molecular formula
- C13H11ClN2S
- Molecular weight
- 262.76
Names & synonyms
1-(2-Chlorophenyl)-3-phenyl-2-thioureaRefChem:421885665-876-41-(2-chlorophenyl)-3-phenylthiourea1932-36-1N-(2-Chlorophenyl)-N'-phenylthiourea3-(2-chlorophenyl)-1-phenylthiourea[(2-chlorophenyl)amino](phenylamino)methane-1-thioneThiourea,N-(2-chlorophenyl)-N'-phenyl-MFCD00022109NSC153655SCHEMBL5446693
Show more names
TIMTEC-BB SBB006315Thiourea, N-(2-chlorophenyl)-N'-phenyl-
DTXSID90351356GJXBIVMCTDXUKR-UHFFFAOYSA-NSBB006315STK034959AKOS000489197NSC-1536553-(2-chlorophenyl)-1-phenyl-isothioureaN-(2-Chlorophenyl)-N'-phenylthiourea #
Database identifiers
- CAS
1932-36-1- PubChem CID
- 698358
- DTXSID
DTXSID90351356- EC Number
- 665-876-4
- Nikkaji
- J1.426.977K
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 56.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 254
Physicochemical properties
- Melting point
- 156 °C · 156°C
- Boiling point
- 371.4 · 371.4±44.0 °C(Predicted)
- Density
- 1.385 · 1.385±0.06 g/cm3(Predicted)
- pka
- 12.05 · 12.05±0.70(Predicted)
- Symbol(GHS)
- 9 · GHS09,GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 315 · H315-H301-H318-H335-H410
- Precautionary statements
- 273 · P273-P391-P501-P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (97.5%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (97.5%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS09,GHS05,GHS06
- hazard_class
- IRRITANT
- Hazard statements
- H315-H301-H318-H335-H410
- Precautionary statements
- P273-P391-P501-P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Suppliers11 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
山东李比希生物医药科技有限公司17866677155 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
菏泽丽泽生物科技有限公司10-15853052 15853052030 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…