2-[Benzyl(ethyl)amino]-1-(3,4-dichlorophenyl)ethanol
Basic information
- CAS
6338-26-7- Standard SMILES
CCN(Cc1ccccc1)CC(O)c1ccc(Cl)c(Cl)c1- InChIKey
ZIIWILKHOWBKRY-UHFFFAOYSA-N- Molecular formula
- C17H19Cl2NO
- Average molar mass
- 324.2 g/mol
- Monoisotopic mass
- 323.0843696
Names & identifiers
- Preferred name
- 2-[Benzyl(ethyl)amino]-1-(3,4-dichlorophenyl)ethanol
- IUPAC
- 2-[benzyl(ethyl)amino]-1-(3,4-dichlorophenyl)ethanol
Names & synonyms
2-[benzyl(ethyl)amino]-1-(3,4-dichlorophenyl)ethanol6338-26-7NSC40413CHEMBL548170DTXSID90285081NSC-404132-[Benzyl(ethyl)amino]-1-(3,4-dichlorophenyl)ethan-1-ol
Database identifiers
- CAS
6338-26-7- PubChem CID
- 237144
- DTXSID
DTXSID90285081- ChEMBL
CHEMBL548170
Properties
Computed structural properties
- XLogP
- 4.2
- 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
- 297
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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