Basic information
- Standard SMILES
C#CCCC(F)C(=O)O- InChIKey
SHYKYPAJOVBVHR-UHFFFAOYSA-N- Molecular formula
- C6H7FO2
- Average molar mass
- 130.12 g/mol
- Monoisotopic mass
- 130.04300762
Names & identifiers
- Preferred name
- 2-Fluorohex-5-ynoic acid
- IUPAC
- 2-fluorohex-5-ynoic acid
Names & synonyms
2-fluorohex-5-ynoic acid2-fluoro-5-hexynoic acidSCHEMBL10810542SHYKYPAJOVBVHR-UHFFFAOYSA-NAKOS006386882F2147-593184163-87-1
Database identifiers
- PubChem CID
- 13044950
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 144
Related reactions
12 records
Compound notes
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