Basic information
- CAS
463-29-6- Standard SMILES
COC(=O)CCCCCCCCCCCCCCCCCF- InChIKey
CYLLSGSDEOHZKK-UHFFFAOYSA-N- Molecular formula
- C19H37FO2
- Average molar mass
- 316.5 g/mol
- Monoisotopic mass
- 316.27775858
Names & identifiers
- Preferred name
- Octadecanoic acid, 18-fluoro-, methyl ester
- IUPAC
- methyl 18-fluorooctadecanoate
- English name
- 18-Fluorooctadecanoic acid methyl ester
- Molecular formula
- C19H37FO2
- Molecular weight
- 316.49
Names & synonyms
463-29-6OCTADECANOIC ACID, 18-FLUORO-, METHYL ESTERDTXSID60196796RefChem:1093755DTXCID00119287Methyl 18-fluorooctadecanoateMethyl 18-fluorostearateBRN 1791191starbld0049440Methyl 18-fluoro-octadecanoateCYLLSGSDEOHZKK-UHFFFAOYSA-N18-Fluorooctadecanoic acid methyl ester
Database identifiers
- CAS
463-29-6- PubChem CID
- 10034
- DTXSID
DTXSID60196796- Nikkaji
- J64.730F
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 18
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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