Basic information
- CAS
3117-64-4- Standard SMILES
COc1ccc(N=Cc2cccc(OC)c2O)cc1- InChIKey
YYMVRDPHQOMSFJ-UHFFFAOYSA-N- Molecular formula
- C15H15NO3
- Average molar mass
- 257.28 g/mol
- Monoisotopic mass
- 257.10519334
Names & identifiers
- Preferred name
- 2-methoxy-6-{(E)-[(4-methoxyphenyl)imino]methyl}phenol
- IUPAC
- 2-methoxy-6-[(4-methoxyphenyl)iminomethyl]phenol
Names & synonyms
2-methoxy-6-{(E)-[(4-methoxyphenyl)imino]methyl}phenol623150-91-43117-64-4CHEMBL4225683Phenol, 2-methoxy-6-[[(4-methoxyphenyl)imino]methyl]-DTXSID304254442-methoxy-6-[(4-methoxyanilino)methylidene]cyclohexa-2,4-dien-1-oneMFCD00556457STK077718AKOS005391688BS-10570
Database identifiers
- CAS
3117-64-4- PubChem CID
- 429031
- DTXSID
DTXSID30425444- ChEMBL
CHEMBL4225683- Nikkaji
- J735.362F
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 51.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 287
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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