4-Hydroxy-5-methoxy-1,3-benzenedicarboxaldehyde 1,3-dioxime
Basic information
- CAS
26230-27-3- Standard SMILES
COc1cc(C=NO)cc(C=NO)c1O- InChIKey
FZBDFWKLMTWREJ-UHFFFAOYSA-N- Molecular formula
- C9H10N2O4
- Average molar mass
- 210.19 g/mol
- Monoisotopic mass
- 210.0640568
Names & identifiers
- Preferred name
- 4-Hydroxy-5-methoxy-1,3-benzenedicarboxaldehyde 1,3-dioxime
- IUPAC
- 2,4-bis(hydroxyiminomethyl)-6-methoxyphenol
Names & synonyms
26230-27-34-Hydroxy-5-methoxy-1,3-benzenedicarboxaldehyde 1,3-dioximeDTXSID401187326NCI60_0407282,4-Bis[(hydroxyimino)methyl]-6-methoxyphenol
Database identifiers
- CAS
26230-27-3- PubChem CID
- 403364
- DTXSID
DTXSID401187326
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
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Compound notes
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