Basic information
- CAS
4138-00-5- Standard SMILES
CCOC(C)=CC=C1CCCCC1- InChIKey
MYFLLXHDBBDCEU-UHFFFAOYSA-N- Molecular formula
- C12H20O
- Average molar mass
- 180.29 g/mol
- Monoisotopic mass
- 180.15141526
Names & identifiers
- Preferred name
- (3-Ethoxybut-2-en-1-ylidene)cyclohexane
- IUPAC
- 3-ethoxybut-2-enylidenecyclohexane
Names & synonyms
4138-00-5DTXSID90785617(3-Ethoxybut-2-en-1-ylidene)cyclohexane
Database identifiers
- CAS
4138-00-5- PubChem CID
- 71361971
- DTXSID
DTXSID90785617
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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