Basic information
- CAS
71712-72-6- Standard SMILES
CCCCCCC=CCCCCCCCC(=O)OC(CO)CO- InChIKey
CXUXMSACCLYMBI-UHFFFAOYSA-N- Molecular formula
- C19H36O4
- Average molar mass
- 328.5 g/mol
- Monoisotopic mass
- 328.26135963
Names & identifiers
- Preferred name
- 1,3-Dihydroxypropan-2-yl hexadec-9-enoate
- IUPAC
- 1,3-dihydroxypropan-2-yl hexadec-9-enoate
Names & synonyms
71712-72-61,3-DIHYDROXYPROPAN-2-YL HEXADEC-9-ENOATEDTXSID90706367RefChem:218641DTXCID60657115
Database identifiers
- CAS
71712-72-6- PubChem CID
- 53745895
- DTXSID
DTXSID90706367
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 285
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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