Basic information
- CAS
99948-82-0- Standard SMILES
CC(=O)O.CCCCCCCC/C=C\CCCCCCCC(=O)OCCN- InChIKey
LRONDRLYVNVWCN-KVVVOXFISA-N- Molecular formula
- C22H43NO4
- Average molar mass
- 385.6 g/mol
- Monoisotopic mass
- 385.31920885
Names & identifiers
- Preferred name
- (2-Hydroxyethyl)oleoylammonium acetate
- IUPAC
- acetic acid;2-aminoethyl (Z)-octadec-9-enoate
Names & synonyms
(2-Hydroxyethyl)oleoylammonium acetateEINECS 309-090-9LRONDRLYVNVWCN-KVVVOXFISA-N
Database identifiers
- CAS
99948-82-0- PubChem CID
- 44150970
- EC Number
- 309-090-9
Properties
Computed structural properties
- Topological polar surface area
- 89.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 18
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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