Basic information
- CAS
349430-05-3- Standard SMILES
N#Cc1ccccc1NC(=O)Cc1ccc(Cl)cc1- InChIKey
PPERTQNWLYPJCC-UHFFFAOYSA-N- Molecular formula
- C15H11ClN2O
- Average molar mass
- 270.71 g/mol
Names & identifiers
- Preferred name
- 2-(4-chlorophenyl)-N-(2-cyanophenyl)acetamide
- IUPAC
- 2-(4-chlorophenyl)-N-(2-cyanophenyl)acetamide
- English name
- 2-(4-chlorophenyl)-N-(2-cyanophenyl)acetamide
- Molecular formula
- C15H11ClN2O
- Molecular weight
- 270.71
Names & synonyms
2-(4-chlorophenyl)-N-(2-cyanophenyl)acetamideOprea1_456111STK080256AKOS000180640ST043820Benzeneacetamide, 4-chloro-N-(2-cyanophenyl)-
Database identifiers
- CAS
349430-05-3
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 52.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 354
Physicochemical properties
- Boiling point
- 514.6 · 514.6±40.0 °C(Predicted)
- Density
- 1.29 · 1.29±0.1 g/cm3(Predicted)
- pka
- 13.2 · 13.20±0.70(Predicted)
Chemistry & industry
Suppliers2 total
VITAS-BB—
UKRORGSYN-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…