Basic information
- CAS
93677-68-0- Standard SMILES
O=C(NNC(=S)Nc1ccccc1)c1ccc(Cl)cc1Cl- InChIKey
PXWIEFCWWVDFBP-UHFFFAOYSA-N- Molecular formula
- C14H11Cl2N3OS
- Average molar mass
- 340.2 g/mol
- Monoisotopic mass
- 338.9999885
Names & identifiers
- Preferred name
- 2-(2,4-Dichlorobenzoyl)-N-phenylhydrazinecarbothioamide
- IUPAC
- 1-[(2,4-dichlorobenzoyl)amino]-3-phenylthiourea
- English name
- 2,4-dichloro-N-[(phenylcarbamothioyl)amino]benzamide
- Molecular formula
- C14H11Cl2N3OS
- Molecular weight
- 340.22764
Names & synonyms
2-(2,4-dichlorobenzoyl)-N-phenylhydrazinecarbothioamideRefChem:45190693677-68-0657-306-8AKOS002222252ST012409(2,4-dichlorophenyl)-N-{[(phenylamino)thioxomethyl]amino}carboxamide2,4-dichloro-N-[(phenylcarbamothioyl)amino]benzamide
Database identifiers
- CAS
93677-68-0- PubChem CID
- 720773
- EC Number
- 657-306-8
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 377
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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