Octyl 9-cyclopropylnonanoate
Basic information
- CAS
61350-83-2- Standard SMILES
CCCCCCCCOC(=O)CCCCCCCCC1CC1- InChIKey
KDWQMNWJOQKYCE-UHFFFAOYSA-N- Molecular formula
- C20H38O2
- Average molar mass
- 310.5 g/mol
- Monoisotopic mass
- 310.28718045
Names & identifiers
- Preferred name
- Octyl 9-cyclopropylnonanoate
- IUPAC
- octyl 9-cyclopropylnonanoate
Names & synonyms
OCTYL 9-CYCLOPROPYLNONANOATE61350-83-2SCHEMBL11853256DTXSID00614984
Database identifiers
- CAS
61350-83-2- PubChem CID
- 21496572
- DTXSID
DTXSID00614984
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 17
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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