Basic information
- Standard SMILES
CCC(O)(c1cccc(C(F)F)c1)C(C)CN(C)C- InChIKey
VIBKCCHMNVUCEA-UHFFFAOYSA-N- Molecular formula
- C15H23F2NO
- Average molar mass
- 271.35 g/mol
- Monoisotopic mass
- 271.17477068
Names & identifiers
- Preferred name
- 3-[3-(Difluoromethyl)phenyl]-1-(dimethylamino)-2-methylpentan-3-ol
- IUPAC
- 3-[3-(difluoromethyl)phenyl]-1-(dimethylamino)-2-methylpentan-3-ol
Names & synonyms
SCHEMBL175658VIBKCCHMNVUCEA-UHFFFAOYSA-N3-[3-(difluoromethyl)phenyl]-1-(dimethylamino)-2-methylpentan-3-ol
Database identifiers
- PubChem CID
- 9943385
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 273
Related reactions
1 records
Compound notes
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