Butyl 2-octenoate
Basic information
- CAS
57403-32-4- Standard SMILES
CCCCC/C=C\C(=O)OCCCC- InChIKey
JACBBOONWJFMBB-KTKRTIGZSA-N- Molecular formula
- C12H22O2
- Average molar mass
- 198.3 g/mol
- Monoisotopic mass
- 198.16197994
Names & identifiers
- Preferred name
- Butyl 2-octenoate
- IUPAC
- butyl (Z)-oct-2-enoate
Names & synonyms
Butyl 2-octenoatebutyl cis-2-octenoateJACBBOONWJFMBB-KTKRTIGZSA-N
Database identifiers
- CAS
57403-32-4- PubChem CID
- 6436679
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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