Basic information
- CAS
352349-73-6- Standard SMILES
Cc1cc(O)c(N=CC=Cc2cccc(Br)c2)cc1C- InChIKey
IPEYQCBOPCIYIV-UHFFFAOYSA-N- Molecular formula
- C17H16BrNO
- Average molar mass
- 330.2 g/mol
Names & identifiers
- Preferred name
- 2-[3-(3-Bromophenyl)prop-2-enylideneamino]-4,5-dimethylphenol
- IUPAC
- 2-[3-(3-bromophenyl)prop-2-enylideneamino]-4,5-dimethylphenol
- English name
- 2-{[3-(3-bromophenyl)-2-propenylidene]amino}-4,5-dimethylphenol
- Molecular formula
- C17H16BrNO
- Molecular weight
- 330.22
Names & synonyms
2-{[3-(3-bromophenyl)-2-propenylidene]amino}-4,5-dimethylphenol
Database identifiers
- CAS
352349-73-6
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 355
Physicochemical properties
- Boiling point
- 493.847 · 493.847±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.26 · 1.260±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.7 · 10.700±0.50(predicted)
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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