Basic information
- CAS
303762-08-5- Standard SMILES
Cc1cc(C)cc(N=Cc2cc(Br)ccc2O)c1- InChIKey
LSHWTUXNKVBZRA-UHFFFAOYSA-N- Molecular formula
- C15H14BrNO
- Average molar mass
- 304.18 g/mol
- Monoisotopic mass
- 303.02588
Names & identifiers
- Preferred name
- 4-Bromo-2-{[(3,5-dimethylphenyl)imino]methyl}phenol
- IUPAC
- 4-bromo-2-[(3,5-dimethylphenyl)iminomethyl]phenol
- English name
- 4-bromo-2-{[(3,5-dimethylphenyl)imino]methyl}phenol
- Molecular formula
- C15H14BrNO
- Molecular weight
- 304.18
Names & synonyms
4-bromo-2-{[(3,5-dimethylphenyl)imino]methyl}phenol4-bromo-2-[(3,5-dimethylphenyl)iminomethyl]phenolMaybridge1_006992HMS561F18MFCD00175368STK003072AKOS000484407ST010340AG-205/077740284-bromo-2-{(E)-[(3,5-dimethylphenyl)imino]methyl}phenol2-[(1E)-2-(3,5-dimethylphenyl)-2-azavinyl]-4-bromophenol4-BROMO-2-((3,5-DIMETHYL-PHENYLIMINO)-METHYL)-PHENOL
Database identifiers
- CAS
303762-08-5- PubChem CID
- 709084
- EC Number
- 167-332-7
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 284
Physicochemical properties
- Boiling point
- 448.918 · 448.918±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.323 · 1.323±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 7.766 · 7.766±0.43(predicted)
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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