Methyl 10-octadecynoate
Basic information
- CAS
26543-36-2- Standard SMILES
CCCCCCCC#CCCCCCCCCC(=O)OC- InChIKey
DTNWBJHYQDKQJM-UHFFFAOYSA-N- Molecular formula
- C19H34O2
- Average molar mass
- 294.5 g/mol
- Monoisotopic mass
- 294.25588032
Names & identifiers
- Preferred name
- Methyl 10-octadecynoate
- IUPAC
- methyl octadec-10-ynoate
- English name
- 10-Octadecynoic acid methyl ester
- Molecular formula
- C19H34O2
- Molecular weight
- 294.47
Names & synonyms
METHYL 10-OCTADECYNOATE26543-36-210-Octadecynoic acid, methyl esterDTXSID10181117RefChem:157162DTXCID20103608DTNWBJHYQDKQJM-UHFFFAOYSA-Nmethyl octadec-10-ynoate10-Octadecynoic acid methyl ester
Database identifiers
- CAS
26543-36-2- PubChem CID
- 33538
- DTXSID
DTXSID10181117- Nikkaji
- J108.669C
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 295
Chemistry & industry
Upstream & downstream products
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Related reactions
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Compound notes
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