Basic information
- CAS
30463-55-9- Standard SMILES
C=CCCCC=CCC(=O)OC- InChIKey
FGFBSRAQZIORCU-UHFFFAOYSA-N- Molecular formula
- C10H16O2
- Average molar mass
- 168.23 g/mol
- Monoisotopic mass
- 168.11502975
Names & identifiers
- Preferred name
- 3,8-Nonadienoic acid, methyl ester
- IUPAC
- methyl nona-3,8-dienoate
Names & synonyms
3,8-Nonadienoic acid, methyl ester30463-55-9DTXSID90338389RefChem:272769DTXCID00289474FGFBSRAQZIORCU-BQYQJAHWSA-NMETHYL NONA-3,8-DIENOATESCHEMBL8054742
Database identifiers
- CAS
30463-55-9- PubChem CID
- 548863
- DTXSID
DTXSID90338389
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 159
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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