Basic information
- CAS
2699610-35-8- Standard SMILES
CCCCCCCCC=CCCCCCCCC(=O)OCC(C)O- InChIKey
ZVTDEEBSWIQAFJ-UHFFFAOYSA-N- Molecular formula
- C21H40O3
- Average molar mass
- 340.5 g/mol
- Monoisotopic mass
- 340.29774513
Names & identifiers
- Preferred name
- 2-Hydroxypropyl octadec-9-enoate
- IUPAC
- 2-hydroxypropyl octadec-9-enoate
Names & synonyms
2-hydroxypropyl octadec-9-enoateDTXSID30859624RefChem:1063463DTXCID408097912-Hydroxypropyl 9-octadecenoateSCHEMBL304228892699610-35-8
Database identifiers
- CAS
2699610-35-8- PubChem CID
- 14901
- DTXSID
DTXSID30859624
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 18
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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