N-(3,4-dichlorophenyl)pentanamide
Basic information
- CAS
2150-96-1- Standard SMILES
CCCCC(=O)Nc1ccc(Cl)c(Cl)c1- InChIKey
BMSSRNRFXGWOEZ-UHFFFAOYSA-N- Molecular formula
- C11H13Cl2NO
- Average molar mass
- 246.13 g/mol
- Monoisotopic mass
- 245.0374194
Names & identifiers
- Preferred name
- N-(3,4-dichlorophenyl)pentanamide
- IUPAC
- N-(3,4-dichlorophenyl)pentanamide
Names & synonyms
N-(3,4-dichlorophenyl)pentanamide2150-96-13',4'-DichlorovaleroanilideDTXSID10876379BMSSRNRFXGWOEZ-UHFFFAOYSA-NAKOS003881615AN-652/40058313
Database identifiers
- CAS
2150-96-1- PubChem CID
- 525045
- DTXSID
DTXSID10876379- Nikkaji
- J418.099B
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 211
Experimental & physicochemical properties
LogP4.17
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Compound notes
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