N'-((E)-{4-[(4-fluorobenzyl)oxy]phenyl}methylidene)-2-phenylacetohydrazide
Basic information
- CAS
331461-71-3- Standard SMILES
O=C(Cc1ccccc1)N/N=C/c1ccc(OCc2ccc(F)cc2)cc1- InChIKey
QQARWHYTDFJUJF-BUVRLJJBSA-N- Molecular formula
- C22H19FN2O2
- Average molar mass
- 362.4 g/mol
- Monoisotopic mass
- 362.14305602
Names & identifiers
- Preferred name
- N'-((E)-{4-[(4-fluorobenzyl)oxy]phenyl}methylidene)-2-phenylacetohydrazide
- IUPAC
- N-[(E)-[4-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2-phenylacetamide
- English name
- N'-[(1E)-{4-[(4-fluorophenyl)methoxy]phenyl}methylidene]-2-phenylacetohydrazide
- Molecular formula
- C22H19FN2O2
- Molecular weight
- 362.4
Names & synonyms
331461-71-3N'-((E)-{4-[(4-fluorobenzyl)oxy]phenyl}methylidene)-2-phenylacetohydrazideN'-[(1E)-{4-[(4-fluorophenyl)methoxy]phenyl}methylidene]-2-phenylacetohydrazideN-[(E)-[4-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-2-phenylacetamideAKOS005106878JS-0681ST028889NS00096899AA-768/32247001N'-{4-[(4-fluorobenzyl)oxy]benzylidene}-2-phenylacetohydrazide(E)-N'-(4-((4-fluorobenzyl)oxy)benzylidene)-2-phenylacetohydrazideN-((1E)-2-{4-[(4-fluorophenyl)methoxy]phenyl}-1-azavinyl)-2-phenylacetamide
Show more names
2-PHENYL-ACETIC ACID (4-(4-FLUORO-BENZYLOXY)-BENZYLIDENE)-HYDRAZIDEBenzeneacetic acid, 2-[[4-[(4-fluorophenyl)methoxy]phenyl]methylene]hydrazide
Database identifiers
- CAS
331461-71-3- PubChem CID
- 9565041
- EC Number
- 151-229-9
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 463
Physicochemical properties
- Density
- 1.143 · 1.143±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 13.544 · 13.544±0.46(predicted)
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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