Basic information
- CAS
94201-06-6- Standard SMILES
COC(=O)C=CC1C(C)=CCC(C)C1(C)C- InChIKey
SGYGXBFZOVLTCS-UHFFFAOYSA-N- Molecular formula
- C14H22O2
- Average molar mass
- 222.32 g/mol
- Monoisotopic mass
- 222.16197994
Names & identifiers
- Preferred name
- Methyl 3-(2,5,6,6-tetramethylcyclohex-2-en-1-yl)prop-2-enoate
- IUPAC
- methyl 3-(2,5,6,6-tetramethylcyclohex-2-en-1-yl)prop-2-enoate
Names & synonyms
SGYGXBFZOVLTCS-UHFFFAOYSA-NDTXSID601181700methyl 3-(2,5,6,6-tetramethylcyclohex-2-en-1-yl)prop-2-enoateMethyl 3-(2,5,6,6-tetramethyl-2-cyclohexen-1-yl)-2-propenoate
Database identifiers
- CAS
94201-06-6- PubChem CID
- 3023976
- DTXSID
DTXSID601181700
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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