2-{[(3-Bromo-4-methylphenyl)imino]methyl}-6-methoxyphenol
Basic information
- CAS
315670-95-2- Standard SMILES
COc1cccc(C=Nc2ccc(C)c(Br)c2)c1O- InChIKey
DNNUZTPVKAIDPH-UHFFFAOYSA-N- Molecular formula
- C15H14BrNO2
- Average molar mass
- 320.18 g/mol
Names & identifiers
- Preferred name
- 2-{[(3-Bromo-4-methylphenyl)imino]methyl}-6-methoxyphenol
- IUPAC
- 2-[(3-bromo-4-methylphenyl)iminomethyl]-6-methoxyphenol
- English name
- 2-{[(3-bromo-4-methylphenyl)imino]methyl}-6-methoxyphenol
- Molecular formula
- C15H14BrNO2
- Molecular weight
- 320.18
Names & synonyms
2-{[(3-bromo-4-methylphenyl)imino]methyl}-6-methoxyphenolSTK066437AKOS000488487(6Z)-6-[(3-bromo-4-methylanilino)methylidene]-2-methoxycyclohexa-2,4-dien-1-oneST035104AN-329/099970412-[(3-bromo-4-methylphenyl)iminomethyl]-6-methoxyphenol2-[(1E)-2-(3-bromo-4-methylphenyl)-2-azavinyl]-6-methoxyphenol2-{(E)-[(3-bromo-4-methylphenyl)imino]methyl}-6-methoxyphenolPhenol, 2-[[(3-bromo-4-methylphenyl)imino]methyl]-6-methoxy-
Database identifiers
- CAS
315670-95-2
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 311
Physicochemical properties
- Boiling point
- 458.8 · 458.8±45.0 °C(Predicted)
- Density
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- pka
- 8.21 · 8.21±0.35(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…