Basic information
- CAS
82821-19-0- Standard SMILES
Fc1ccc(C=Nc2cc(Cl)cc(Cl)c2)cc1- InChIKey
JANXXARWZJZKBL-UHFFFAOYSA-N- Molecular formula
- C13H8Cl2FN
- Average molar mass
- 268.11 g/mol
- Monoisotopic mass
- 267.0017828
Names & identifiers
- Preferred name
- Benzenamine, 3,5-dichloro-N-[(4-fluorophenyl)methylene]-
- IUPAC
- N-(3,5-dichlorophenyl)-1-(4-fluorophenyl)methanimine
Names & synonyms
(1E)-1-(3,5-dichlorophenyl)-2-(4-fluorophenyl)-1-azaethene82821-19-0Benzenamine, 3,5-dichloro-N-[(4-fluorophenyl)methylene]-SCHEMBL7261907SCHEMBL7261909DTXSID80351103AKOS003409508ST0096383,5-Dichloro-N-(4-fluorobenzylidene)aniline(3,5-dichloro-phenyl)-(4-fluoro-benzylidene)-amine(E)-N-(3,5-Dichlorophenyl)-1-(4-fluorophenyl)methanimine
Database identifiers
- CAS
82821-19-0- PubChem CID
- 690809
- DTXSID
DTXSID80351103- EC Number
- 141-560-7
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 12.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 254
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, 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 CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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