Basic information
- CAS
67428-77-7- Standard SMILES
CCN(CC)CC(O)c1ccc(Cl)cc1- InChIKey
SCDVMBDRHVNOKM-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO
- Average molar mass
- 227.73 g/mol
- Monoisotopic mass
- 227.1076919
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-2-(diethylamino)ethanol
- IUPAC
- 1-(4-chlorophenyl)-2-(diethylamino)ethanol
Names & synonyms
67428-77-71-(4-chlorophenyl)-2-(diethylamino)ethanolNSC408241-(4-chlorophenyl)-2-(diethylamino)ethan-1-olDTXSID30285181NSC-40824AKOS034036148Z280051412
Database identifiers
- CAS
67428-77-7- PubChem CID
- 237397
- DTXSID
DTXSID30285181
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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