Benzene, 1-fluoro-3-(1-hydroxy-2-isopropylamino)ethyl-
Basic information
- CAS
451-04-7- Standard SMILES
CC(C)NCC(O)c1cccc(F)c1- InChIKey
IDAZVHMZFWXZDW-UHFFFAOYSA-N- Molecular formula
- C11H16FNO
- Average molar mass
- 197.25 g/mol
- Monoisotopic mass
- 197.1215923
Names & identifiers
- Preferred name
- Benzene, 1-fluoro-3-(1-hydroxy-2-isopropylamino)ethyl-
- IUPAC
- 1-(3-fluorophenyl)-2-(propan-2-ylamino)ethanol
Names & synonyms
benzene, 1-fluoro-3-(1-hydroxy-2-isopropylamino)ethyl-NoName_3351SCHEMBL10485403451-04-7
Database identifiers
- CAS
451-04-7- PubChem CID
- 48900
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 163
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Compound notes
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