Basic information
- CAS
593-11-3- Standard SMILES
O=C(O)CCCCCCCCCCCF- InChIKey
ZEDMVKOURHPQLY-UHFFFAOYSA-N- Molecular formula
- C12H23FO2
- Average molar mass
- 218.31 g/mol
- Monoisotopic mass
- 218.16820813
Names & identifiers
- Preferred name
- Dodecanoic acid, 12-fluoro-
- IUPAC
- 12-fluorododecanoic acid
- English name
- 12-Fluorododecanoic acid
- Molecular formula
- C12H23FO2
- Molecular weight
- 218.31
Names & synonyms
12-Fluorododecanoic acid593-11-3DODECANOIC ACID, 12-FLUORO-omega-Fluorododecanoic acidNSC 665967BRN 1771587DTXSID602080204-02-00-01105 (Beilstein Handbook Reference)RefChem:339470DTXCID80130511C8B3FGK6K3NSC665967
Show more names
NSC-665967starbld0044941UNII-C8B3FGK6K3SCHEMBL8863679
Database identifiers
- CAS
593-11-3- PubChem CID
- 11624
- DTXSID
DTXSID60208020- UNII
- C8B3FGK6K3
- Nikkaji
- J42.967H
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- FDA UNII
- 8 B3FGK6K3 · C8B3FGK6K3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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