Basic information
- CAS
5436-18-0- Standard SMILES
CC(=NNc1ccc(Cl)cc1)C(=O)O- InChIKey
BFRDBVHWNKDMOG-UHFFFAOYSA-N- Molecular formula
- C9H9ClN2O2
- Average molar mass
- 212.63 g/mol
- Monoisotopic mass
- 212.0352552
Names & identifiers
- Preferred name
- 2-[2-(4-Chlorophenyl)hydrazinylidene]propanoic acid
- IUPAC
- 2-[(4-chlorophenyl)hydrazinylidene]propanoic acid
Names & synonyms
2-[(4-chlorophenyl)hydrazinylidene]propanoic acid2-[2-(4-chlorophenyl)hydrazinylidene]propanoic acidSCHEMBL2172551DTXSID90969450BFRDBVHWNKDMOG-UHFFFAOYSA-N2-(p-chlorophenylhydrazono)propionic acidDS-0126982-(4-Chlorophenyl hydrazono) propionic acid
Database identifiers
- CAS
5436-18-0- PubChem CID
- 228463
- DTXSID
DTXSID90969450
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 235
Related reactions
3 records
Compound notes
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