Basic information
- CAS
70000-55-4- Standard SMILES
CC1CCC(NCc2ccc(Cl)cc2)CC1- InChIKey
WMAXAKJYQDFWIO-UHFFFAOYSA-N- Molecular formula
- C14H20ClN
- Average molar mass
- 237.77 g/mol
- Monoisotopic mass
- 237.1284273
Names & identifiers
- Preferred name
- N-[(4-chlorophenyl)methyl]-4-methylcyclohexan-1-amine
- IUPAC
- N-[(4-chlorophenyl)methyl]-4-methylcyclohexan-1-amine
Names & synonyms
N-[(4-chlorophenyl)methyl]-4-methylcyclohexan-1-amine70000-55-4DTXSID801234397AKOS008990821CID 129014554-Chloro-N-(4-methylcyclohexyl)benzenemethanamineF1967-9834
Database identifiers
- CAS
70000-55-4- PubChem CID
- 12901455
- DTXSID
DTXSID801234397
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 191
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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