2-Cyclohexylidenebutanedioic acid
Basic information
- CAS
3283-27-0- Standard SMILES
O=C(O)CC(C(=O)O)=C1CCCCC1- InChIKey
OYFNXVPCXAXJGS-UHFFFAOYSA-N- Molecular formula
- C10H14O4
- Average molar mass
- 198.22 g/mol
- Monoisotopic mass
- 198.08920892
Names & identifiers
- Preferred name
- 2-Cyclohexylidenebutanedioic acid
- IUPAC
- 2-cyclohexylidenebutanedioic acid
Names & synonyms
2-cyclohexylidenebutanedioic acid3283-27-0DTXSID50282278RefChem:259901DTXCID00233432.DELTA.1,.alpha.-Cyclohexanesuccinic acidcyclohexylidenesuccinic acidSCHEMBL28661006NSC25327NSC-25327DS-013183
Database identifiers
- CAS
3283-27-0- PubChem CID
- 230421
- DTXSID
DTXSID50282278- Nikkaji
- J593.580F
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 270
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Compound notes
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