4-Bromo-2-((2,5-dimethoxy-phenylimino)-methyl)-phenol
Basic information
- CAS
316129-90-5- Standard SMILES
COc1ccc(OC)c(N=Cc2cc(Br)ccc2O)c1- InChIKey
OMHHQSYZJNFGTF-UHFFFAOYSA-N- Molecular formula
- C15H14BrNO3
- Average molar mass
- 336.18 g/mol
- Monoisotopic mass
- 335.01571
Names & identifiers
- Preferred name
- 4-Bromo-2-((2,5-dimethoxy-phenylimino)-methyl)-phenol
- IUPAC
- 4-bromo-2-[(2,5-dimethoxyphenyl)iminomethyl]phenol
- English name
- (E)-4-bromo-2-(((2,5-dimethoxyphenyl)imino)methyl)phenol
- Molecular formula
- C15H14BrNO3
- Molecular weight
- 336.18
Names & synonyms
2-[(1E)-2-(2,5-dimethoxyphenyl)-2-azavinyl]-4-bromophenolSTK730381AKOS003408751ST010311(E)-4-bromo-2-(((2,5-dimethoxyphenyl)imino)methyl)phenol4-bromo-2-{(E)-[(2,5-dimethoxyphenyl)imino]methyl}phenol4-BROMO-2-((2,5-DIMETHOXY-PHENYLIMINO)-METHYL)-PHENOLPhenol, 4-bromo-2-[[(2,5-dimethoxyphenyl)imino]methyl]-
Database identifiers
- CAS
316129-90-5- PubChem CID
- 710131
- EC Number
- 167-307-0
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 51.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- Melting point
- 110 °C · 110 °C(Solvent: Ethanol)
- Boiling point
- 513.471 · 513.471±50.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.384 · 1.384±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 7.564 · 7.564±0.43(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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