Basic information
- CAS
20586-29-2- Standard SMILES
COC(=O)C1CC=C(C)CC1C(=O)OC- InChIKey
GODQWBQDOFWJQS-UHFFFAOYSA-N- Molecular formula
- C11H16O4
- Average molar mass
- 212.24 g/mol
- Monoisotopic mass
- 212.10485899
Names & identifiers
- Preferred name
- 4-Cyclohexene-1,2-dicarboxylic acid, 4-methyl-, dimethyl ester
- IUPAC
- dimethyl 4-methylcyclohex-4-ene-1,2-dicarboxylate
Names & synonyms
4-Cyclohexene-1,2-dicarboxylic acid, 4-methyl-, dimethyl ester20586-29-2Dimethyl 4-methyl-4-cyclohexene-1,2-dicarboxylateNSC1204074-methyl-cyclohex-4-ene-1,2-dicarboxylic acid dimethyl esterdimethyl 4-methylcyclohex-4-ene-1,2-dicarboxylateSCHEMBL5531100DTXSID80942777NSC-1204074-Cyclohexene-1, 4-methyl-, dimethyl ester, trans-Dimethyl 4-methyl-4-cyclohexene-1,2-dicarboxylate #
Database identifiers
- CAS
20586-29-2- PubChem CID
- 274379
- DTXSID
DTXSID80942777- Nikkaji
- J520.308B
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 293
Related reactions
1 records
Compound notes
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