Trimethyl cyclohex-5-ene-1,2,4-tricarboxylate
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Basic information
- Standard SMILES
COC(=O)C1C=CC(C(=O)OC)C(C(=O)OC)C1- InChIKey
CVXHHLMEWWGSIX-UHFFFAOYSA-N- Molecular formula
- C12H16O6
- Average molar mass
- 256.25 g/mol
- Monoisotopic mass
- 256.09468823
Names & identifiers
- Preferred name
- Trimethyl cyclohex-5-ene-1,2,4-tricarboxylate
- IUPAC
- trimethyl cyclohex-5-ene-1,2,4-tricarboxylate
Names & synonyms
trimethyl cyclohex-5-ene-1,2,4-tricarboxylateSCHEMBL818518CVXHHLMEWWGSIX-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 60136166
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 373
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Related reactions
9 records
Compound notes
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