Basic information
- Standard SMILES
CC(CCN)c1cccc(Cl)c1- InChIKey
DKPPEDKATRTMDP-UHFFFAOYSA-N- Molecular formula
- C10H14ClN
- Average molar mass
- 183.68 g/mol
Names & identifiers
- Preferred name
- 3-(3-Chlorophenyl)butan-1-amine
- IUPAC
- 3-(3-chlorophenyl)butan-1-amine
Names & synonyms
3-(3-chlorophenyl)butan-1-amine179381-95-4SCHEMBL6221143DKPPEDKATRTMDP-UHFFFAOYSA-NAKOS0175149903-methyl-3-(3-chlorophenyl)propylamineEN300-1242056
Database identifiers
- PubChem CID
- 22011064
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 127
Related reactions
2 records
Compound notes
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