N-(2-benzoyl-4-chlorophenyl)-3-chloro-2,2-dimethylpropanamide
Basic information
- CAS
303985-83-3- Standard SMILES
CC(C)(CCl)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1- InChIKey
BAIDGYDKIWSTIQ-UHFFFAOYSA-N- Molecular formula
- C18H17Cl2NO2
- Average molar mass
- 350.2 g/mol
- Monoisotopic mass
- 349.0636342
Names & identifiers
- Preferred name
- N-(2-benzoyl-4-chlorophenyl)-3-chloro-2,2-dimethylpropanamide
- IUPAC
- N-(2-benzoyl-4-chlorophenyl)-3-chloro-2,2-dimethylpropanamide
- English name
- N-(2-BENZOYL-4-CHLOROPHENYL)-3-CHLORO-2,2-DIMETHYLPROPANAMIDE
- Molecular formula
- C18H17Cl2NO2
- Molecular weight
- 350.24
Names & synonyms
N-(2-benzoyl-4-chlorophenyl)-3-chloro-2,2-dimethylpropanamide303985-83-3MFCD00793378DTXSID001180823AKOS00507818811L-704N-(2-benzoyl-4-chloro-phenyl)-3-chloro-2,2-dimethyl-propanamidePropanamide, N-(2-benzoyl-4-chlorophenyl)-3-chloro-2,2-dimethyl-
Database identifiers
- CAS
303985-83-3- PubChem CID
- 2767526
- DTXSID
DTXSID001180823
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 433
Physicochemical properties
- Boiling point
- 551.6 · 551.6±50.0 °C(Predicted)
- Density
- 1.28 · 1.280±0.06 g/cm3(Predicted)
- pka
- 12.8 · 12.80±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
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Compound notes
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