Basic information
- CAS
30368-30-0- Standard SMILES
CCC(CCCCCC(=O)OC)c1ccccc1- InChIKey
BNLVORMUBXRTDK-UHFFFAOYSA-N- Molecular formula
- C16H24O2
- Average molar mass
- 248.36 g/mol
- Monoisotopic mass
- 248.17763
Names & identifiers
- Preferred name
- Methyl 7-phenylnonanoate
- IUPAC
- methyl 7-phenylnonanoate
- English name
- 7-Phenylnonanoic acid methyl ester
- Molecular formula
- C16H24O2
- Molecular weight
- 248.36
Names & synonyms
Methyl 7-phenylnonanoateNonanoic acid, 7-phenyl-, methyl ester30368-30-0DTXSID10340202RefChem:356424DTXCID90291283BNLVORMUBXRTDK-UHFFFAOYSA-N7-Phenylnonanoic acid methyl esterBenzeneheptanoic acid, ζ-ethyl-, methyl ester
Database identifiers
- CAS
30368-30-0- PubChem CID
- 562425
- DTXSID
DTXSID10340202- Nikkaji
- J102.913D
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 219
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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