(2Z)-2-(1-Phenylethylidene)butanedioic acid
Basic information
- CAS
58266-39-0- Standard SMILES
C/C(=C(\CC(=O)O)C(=O)O)c1ccccc1- InChIKey
FDIXNAXZGRMYGR-NTMALXAHSA-N- Molecular formula
- C12H12O4
- Average molar mass
- 220.22 g/mol
- Monoisotopic mass
- 220.07355886
Names & identifiers
- Preferred name
- (2Z)-2-(1-Phenylethylidene)butanedioic acid
- IUPAC
- (2Z)-2-(1-phenylethylidene)butanedioic acid
Names & synonyms
(2Z)-2-(1-Phenylethylidene)butanedioic acidDTXSID10103192058266-39-0
Database identifiers
- CAS
58266-39-0- PubChem CID
- 12561306
- DTXSID
DTXSID101031920
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 311
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Compound notes
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