(3-methylcyclohexyl) (E)-2-methylbut-2-enoate
Basic information
- CAS
106199-94-4- Standard SMILES
C/C=C(\C)C(=O)OC1CCCC(C)C1- InChIKey
IGFWWOOBFDXJRX-ONNFQVAWSA-N- Molecular formula
- C12H20O2
- Average molar mass
- 196.29 g/mol
- Monoisotopic mass
- 196.14632988
Names & identifiers
- Preferred name
- (3-methylcyclohexyl) (E)-2-methylbut-2-enoate
- IUPAC
- (3-methylcyclohexyl) (E)-2-methylbut-2-enoate
Names & synonyms
(3-methylcyclohexyl) (E)-2-methylbut-2-enoate106199-94-4
Database identifiers
- CAS
106199-94-4- PubChem CID
- 6442932
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 230
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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