N-(2-(2-(4-Chlorobenzylidene)hydrazino)-2-oxoethyl)-4-fluorobenzamide
Basic information
- CAS
468073-17-8- Standard SMILES
O=C(CNC(=O)c1ccc(F)cc1)N/N=C/c1ccc(Cl)cc1- InChIKey
CCFBHQKTXYUPSX-AWQFTUOYSA-N- Molecular formula
- C16H13ClFN3O2
- Average molar mass
- 333.74 g/mol
- Monoisotopic mass
- 333.0680325
Names & identifiers
- Preferred name
- N-(2-(2-(4-Chlorobenzylidene)hydrazino)-2-oxoethyl)-4-fluorobenzamide
- IUPAC
- N-[2-[(2E)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]-4-fluorobenzamide
- English name
- SALOR-INT L453714-1EA
- Molecular formula
- C16H13ClFN3O2
- Molecular weight
- 333.75
Names & synonyms
N-(2-(2-(4-CHLOROBENZYLIDENE)HYDRAZINO)-2-OXOETHYL)-4-FLUOROBENZAMIDERefChem:824579468073-17-8656-501-5AKOS024416743SALOR-INT L453714-1EA
Database identifiers
- CAS
468073-17-8- PubChem CID
- 9636749
- EC Number
- 656-501-5
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 431
Physicochemical properties
- Density
- 1.314 · 1.314±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.949 · 11.949±0.46(predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P273-P391-P501
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)
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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H400-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P273-P391-P501
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…