2-[2-(3-Methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzoic acid
Basic information
- CAS
25538-78-7- Standard SMILES
COc1cc(N=Nc2ccccc2C(=O)O)ccc1O- InChIKey
CZGWCKMLZNHPDG-UHFFFAOYSA-N- Molecular formula
- C14H12N2O4
- Average molar mass
- 272.26 g/mol
- Monoisotopic mass
- 272.07970687
Overview
2-[2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzoic acid is a member of benzoic acids.
Names & identifiers
- Preferred name
- 2-[2-(3-Methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzoic acid
- IUPAC
- 2-[(4-hydroxy-3-methoxyphenyl)diazenyl]benzoic acid
Names & synonyms
MLS00076617625538-78-72-[2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzoic acidNSC153172CHEMBL1423421CHEMBL4296846DTXSID50586602CHEBI:109781HMS2886O04NSC-153172SMR0005286462-[(4-hydroxy-3-methoxyphenyl)diazenyl]benzoic acid
Show more names
Q271890692-[(2E)-2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoic acid
Database identifiers
- CAS
25538-78-7- PubChem CID
- 290184
- DTXSID
DTXSID50586602- ChEMBL
CHEMBL1423421、CHEMBL4296846- ChEBI
CHEBI:109781
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 91.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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