Basic information
- CAS
353-25-3- Standard SMILES
O=C(O)CCCCCCCF- InChIKey
SAEPUDOYZJDXEX-UHFFFAOYSA-N- Molecular formula
- C8H15FO2
- Average molar mass
- 162.2 g/mol
- Monoisotopic mass
- 162.10560788
Names & identifiers
- Preferred name
- 8-Fluorooctanoic acid
- IUPAC
- 8-fluorooctanoic acid
- English name
- 8-fluorooctanoic acid
- Molecular formula
- C8H15FO2
- Molecular weight
- 162.2
Names & synonyms
8-Fluorooctanoic acid353-25-3DTXSID70188804RefChem:107103DTXCID90111295omega-Fluoroctanoic acidOctanoic acid,8-fluoro-BRN 1756102OCTANOIC ACID, 8-FLUORO-8-FluorooctanoicacidMFCAs n=7SCHEMBL4609065
Show more names
8-Fluorocaprylic acid
MFCD01711084AKOS006277370H83821
Database identifiers
- CAS
353-25-3- PubChem CID
- 9616
- DTXSID
DTXSID70188804- Nikkaji
- J42.518D
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 104
Physicochemical properties
- Melting point
- 35 °C · 35°C
- Boiling point
- 145 · 145-148 °C(Press: 10 Torr)
- Density
- 0.9871 · 0.9871 (estimate)
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Low-Melting Solid
- pka
- 4.77 · 4.77±0.10(Predicted)
- color
- White to Off-White
Chemistry & industry
Applications
Uses8-Fluorooctanoic acid is used in the synthesis of a monofluoro 3-alkyl-2-hydroxy-1,4-naphthoquinone as a potential anti-malarial drug. It is also used in site-specific fluorination of biomolecules catalyzed by lipoic acid ligase.
Suppliers2 total
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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