Basic information
- CAS
302820-84-4- Standard SMILES
O=C(NC(Nc1ccccc1)C(Cl)(Cl)Cl)c1cccc(Cl)c1- InChIKey
JQMBNNLFHSDNHV-UHFFFAOYSA-N- Molecular formula
- C15H12Cl4N2O
- Average molar mass
- 378.1 g/mol
- Monoisotopic mass
- 375.970374
Names & identifiers
- Preferred name
- N-(1-anilino-2,2,2-trichloroethyl)-3-chlorobenzamide
- IUPAC
- N-(1-anilino-2,2,2-trichloroethyl)-3-chlorobenzamide
- English name
- N-(1-Anilino-2,2,2-trichloroethyl)-3-chlorobenzamide
- Molecular formula
- C15H12Cl4N2O
- Molecular weight
- 378.08
Names & synonyms
N-(1-anilino-2,2,2-trichloroethyl)-3-chlorobenzamideSTK809799AKOS001603395AKOS0162895743-chloro-N-[2,2,2-trichloro-1-(phenylamino)ethyl]benzamideBenzamide, 3-chloro-N-[2,2,2-trichloro-1-(phenylamino)ethyl]-
Database identifiers
- CAS
302820-84-4- PubChem CID
- 3633652
- EC Number
- 169-329-6
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 369
Physicochemical properties
- Boiling point
- 525.183 · 525.183±50.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.473 · 1.473±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.183 · 11.183±0.46(predicted)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMA ALDRICH IRELAND LTD[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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