Basic information
- CAS
325471-45-2- Standard SMILES
Oc1ccc(Br)cc1C=Nc1ccccc1F- InChIKey
XFARSEXTBJQNRF-UHFFFAOYSA-N- Molecular formula
- C13H9BrFNO
- Average molar mass
- 294.12 g/mol
- Monoisotopic mass
- 292.98515
Names & identifiers
- Preferred name
- 4-bromo-2-{(E)-[(2-fluorophenyl)imino]methyl}phenol
- IUPAC
- 4-bromo-2-[(2-fluorophenyl)iminomethyl]phenol
Names & synonyms
4-bromo-2-{(E)-[(2-fluorophenyl)imino]methyl}phenol4-bromo-2-[(2-fluorophenyl)iminomethyl]phenol1351481-69-0325471-45-2SCHEMBL15600630STK900302AKOS001263461AKOS030751961BS-10516ST010315EU-00696314-bromo-2-{[(2-fluorophenyl)imino]methyl}phenol
Show more names
Z577042722-[(1E)-2-(2-fluorophenyl)-2-azavinyl]-4-bromophenol
Database identifiers
- CAS
325471-45-2- PubChem CID
- 710140
- EC Number
- 167-309-1
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 274
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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