Basic information
- Standard SMILES
CC(C)Oc1ccc(C(=O)O)cc1F- InChIKey
AFUBNDBLNISVBB-UHFFFAOYSA-N- Molecular formula
- C10H11FO3
- Average molar mass
- 198.19 g/mol
Names & identifiers
- Preferred name
- 3-Fluoro-4-isopropoxybenzoic acid
- IUPAC
- 3-fluoro-4-propan-2-yloxybenzoic acid
Names & synonyms
3-Fluoro-4-isopropoxybenzoic acid258273-30-23-Fluoro-4-(1-methylethoxy)benzoic acidMFCD111566033-fluoro-4-propan-2-yloxybenzoic acid3-fluoro-4-isopropoxy-benzoic acid4-isopropoxy-3-fluorobenzoic acidBenzoic acid, 3-fluoro-4-(1-methylethoxy)-SCHEMBL10917553-Fluoro-4-isopropoxybenzoicacidAFUBNDBLNISVBB-UHFFFAOYSA-NAC5747
Show more names
EOS-62168AKOS000264166SY235550DB-123495F803736
Database identifiers
- PubChem CID
- 17902884
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 206
Related reactions
8 records
Compound notes
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