Basic information
- CAS
439801-59-9- Standard SMILES
C=Cc1ccc(CC(=O)[O-])cc1.[Na+]- InChIKey
LWTWGQBBHQNUIH-UHFFFAOYSA-M- Molecular formula
- C10H9NaO2
- Average molar mass
- 184.17 g/mol
Names & identifiers
- Preferred name
- Sodium 2-(4-ethenylphenyl)acetate
- IUPAC
- sodium 2-(4-ethenylphenyl)acetate
- English name
- Benzeneacetic acid, 4-ethenyl-, sodium salt (9CI)
- Molecular formula
- C10H9NaO2
- Molecular weight
- 184.16703
Names & synonyms
SCHEMBL29109718439801-59-9Benzeneacetic acid, 4-ethenyl-, sodium salt (9CI)
Database identifiers
- CAS
439801-59-9- Nikkaji
- J1.748.807D
Properties
Computed structural properties
- Topological polar surface area
- 40.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 172
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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