Methyl 4-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoate
Basic information
- CAS
26257-98-7- Standard SMILES
COC(=O)c1ccc(N=Nc2ccc(O)cc2)cc1- InChIKey
DRPBGLUKSFZDGU-UHFFFAOYSA-N- Molecular formula
- C14H12N2O3
- Average molar mass
- 256.26 g/mol
- Monoisotopic mass
- 256.08479225
Names & identifiers
- Preferred name
- Methyl 4-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoate
- IUPAC
- methyl 4-[(4-hydroxyphenyl)diazenyl]benzoate
Names & synonyms
26257-98-7methyl 4-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoateSCHEMBL10085044SCHEMBL23986228DTXSID80492989METHYL 4-[2-(4-OXOCYCLOHEXA-2,5-DIEN-1-YLIDENE)HYDRAZIN-1-YL]BENZOATE
Database identifiers
- CAS
26257-98-7- PubChem CID
- 136239694
- DTXSID
DTXSID80492989
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 71.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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