4-Bromo-2-((2-iodo-phenylimino)-methyl)-phenol
Basic information
- CAS
329936-05-2- Standard SMILES
Oc1ccc(Br)cc1C=Nc1ccccc1I- InChIKey
UJBDPDSNLAIHJW-UHFFFAOYSA-N- Molecular formula
- C13H9BrINO
- Average molar mass
- 402.02 g/mol
- Monoisotopic mass
- 400.89122
Names & identifiers
- Preferred name
- 4-Bromo-2-((2-iodo-phenylimino)-methyl)-phenol
- IUPAC
- 4-bromo-2-[(2-iodophenyl)iminomethyl]phenol
- English name
- 4-Bromo-2-((2-iodo-phenylimino)-methyl)-phenol
- Molecular formula
- C13H9BrINO
- Molecular weight
- 402.03
Names & synonyms
AKOS003671957ST0103432-[(1E)-2-(2-iodophenyl)-2-azavinyl]-4-bromophenol4-BROMO-2-((2-IODO-PHENYLIMINO)-METHYL)-PHENOLPhenol, 4-bromo-2-[[(2-iodophenyl)imino]methyl]-
Database identifiers
- CAS
329936-05-2- PubChem CID
- 1286567
- EC Number
- 167-789-2
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 274
Physicochemical properties
- Boiling point
- 479.113 · 479.113±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.852 · 1.852±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 7.606 · 7.606±0.43(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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