4-((4-Chlorobenzyl)oxy)-N'-(2-(trifluoromethyl)benzylidene)benzohydrazide
Basic information
- CAS
396661-39-5- Standard SMILES
O=C(N/N=C/c1ccccc1C(F)(F)F)c1ccc(OCc2ccc(Cl)cc2)cc1- InChIKey
KWVWEIVJZUCQPK-UVHMKAGCSA-N- Molecular formula
- C22H16ClF3N2O2
- Average molar mass
- 432.8 g/mol
- Monoisotopic mass
- 432.0852399
Names & identifiers
- Preferred name
- 4-((4-Chlorobenzyl)oxy)-N'-(2-(trifluoromethyl)benzylidene)benzohydrazide
- IUPAC
- 4-[(4-chlorophenyl)methoxy]-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]benzamide
Names & synonyms
4-((4-Chlorobenzyl)oxy)-N'-(2-(trifluoromethyl)benzylidene)benzohydrazide396661-39-5RefChem:509394656-044-1AKOS0244178834-[(4-chlorobenzyl)oxy]-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}benzohydrazide
Database identifiers
- CAS
396661-39-5- PubChem CID
- 45054331
- EC Number
- 656-044-1
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 571
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
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
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Related reactions
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Compound notes
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