2-[Benzyl(propan-2-yl)amino]-1-(4-chlorophenyl)ethanol
Basic information
- CAS
6317-03-9- Standard SMILES
CC(C)N(Cc1ccccc1)CC(O)c1ccc(Cl)cc1- InChIKey
NZGPVVILHDQKBZ-UHFFFAOYSA-N- Molecular formula
- C18H22ClNO
- Average molar mass
- 303.8 g/mol
- Monoisotopic mass
- 303.138992
Names & identifiers
- Preferred name
- 2-[Benzyl(propan-2-yl)amino]-1-(4-chlorophenyl)ethanol
- IUPAC
- 2-[benzyl(propan-2-yl)amino]-1-(4-chlorophenyl)ethanol
Names & synonyms
6317-03-92-[benzyl(propan-2-yl)amino]-1-(4-chlorophenyl)ethanolDTXSID70285089NSC40444NSC-40444NSC123856NSC-1238562-[Benzyl(propan-2-yl)amino]-1-(4-chlorophenyl)ethan-1-ol
Database identifiers
- CAS
6317-03-9- PubChem CID
- 237157
- DTXSID
DTXSID70285089
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 283
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Compound notes
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