Basic information
- CAS
119450-16-7- Standard SMILES
CCCCCCCCOC(=O)CCC(=O)OCc1ccccc1- InChIKey
JKDPVSKXVPWGCQ-UHFFFAOYSA-N- Molecular formula
- C19H28O4
- Average molar mass
- 320.4 g/mol
- Monoisotopic mass
- 320.19875937
Names & identifiers
- Preferred name
- Octyl benzyl succinate
- IUPAC
- 4-O-benzyl 1-O-octyl butanedioate
Names & synonyms
Octyl benzyl succinateButanedioic acid, octyl phenylmethyl ester119450-16-7DTXSID50335990RefChem:366928DTXCID80287079JKDPVSKXVPWGCQ-UHFFFAOYSA-NBenzyl octyl butanedioate1-Benzyl 4-octyl succinate1-Benzyl 4-octyl succinate #SCHEMBL16344692
Database identifiers
- CAS
119450-16-7- PubChem CID
- 528266
- DTXSID
DTXSID50335990
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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