Basic information
- CAS
514220-17-8- Standard SMILES
O=C(N/N=C/c1ccc(F)cc1)C(=O)Nc1cc(Cl)ccc1Cl- InChIKey
VNJAIQMOQVPVMP-UFWORHAWSA-N- Molecular formula
- C15H10Cl2FN3O2
- Average molar mass
- 354.2 g/mol
- Monoisotopic mass
- 353.0134101
Names & identifiers
- Preferred name
- N-(2,5-dichlorophenyl)-N'-[(E)-(4-fluorophenyl)methylideneamino]oxamide
- IUPAC
- N-(2,5-dichlorophenyl)-N'-[(E)-(4-fluorophenyl)methylideneamino]oxamide
- English name
- N-(2,5-dichlorophenyl)-2-[2-(4-fluorobenzylidene)hydrazino]-2-oxoacetamide
- Molecular formula
- C15H10Cl2FN3O2
- Molecular weight
- 354.16
Names & synonyms
N-(2,5-dichlorophenyl)-N'-[(E)-(4-fluorophenyl)methylideneamino]oxamideN-(2,5-dichlorophenyl)-2-[2-(4-fluorobenzylidene)hydrazino]-2-oxoacetamideSTK958487AKOS003792206AK-968/40399040N-(2,5-dichlorophenyl)-2-[(2E)-2-(4-fluorobenzylidene)hydrazino]-2-oxoacetamideN-(2,5-dichlorophenyl)-2-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-2-oxoacetamide514220-17-8
Database identifiers
- CAS
514220-17-8- PubChem CID
- 6874232
- EC Number
- 128-222-4
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 456
Physicochemical properties
- Density
- 1.432 · 1.432±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 9.487 · 9.487±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%)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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