Basic information
- CAS
351-05-3- Standard SMILES
O=C(CF)Nc1ccc(Br)cc1- InChIKey
ACCDBHBOYZJSDT-UHFFFAOYSA-N- Molecular formula
- C8H7BrFNO
- Average molar mass
- 232.05 g/mol
- Monoisotopic mass
- 230.9695
Names & identifiers
- Preferred name
- Acetamide, N-(4-bromophenyl)-2-fluoro-
- IUPAC
- N-(4-bromophenyl)-2-fluoroacetamide
- English name
- N-(4-bromophenyl)-2-fluoro-acetamide
- Molecular formula
- C8H7BrFNO
- Molecular weight
- 232.05
Names & synonyms
N-(4-Bromophenyl)-2-fluoroacetamideYanomiteFluoroaceto-p-bromoanilide4'-Bromo-2-fluoroacetanilideBRN 2718782Acetamide, N-(4-bromophenyl)-2-fluoro-ACETANILIDE, 4'-BROMO-2-FLUORO-DTXSID401885934-12-00-01505 (Beilstein Handbook Reference)RefChem:315362DTXCID00111084Acetamide, N-(4-bromophenyl)-2-fluoro-(9CI)
Show more names
NEBN-ethylbuphedronep-Bromo-2-fluoroacetanilideFluoroaceto-p-bromo anilineMONOFLUOROACETO-P-BROMOANILIDE
351-05-3FABAAcetamide, N-(4-bromophenyl)-2-fluoro- (9CI)SCHEMBL3472843ACCDBHBOYZJSDT-UHFFFAOYSA-NN-(4-BROMOPHENYL)-2-FLUORO-ACETAMIDE
Database identifiers
- CAS
351-05-3- PubChem CID
- 9593
- DTXSID
DTXSID40188593- Nikkaji
- J3.279D
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 157
Physicochemical properties
- Melting point
- 132 °C · 132 °C
- Boiling point
- 364.5 · 364.5±27.0 °C(Predicted)
- Density
- 1.609 · 1.609±0.06 g/cm3(Predicted)
- pka
- 11.84 · 11.84±0.70(Predicted)
- FDA UNII
- 6 VC063Q · VUF6VC063Q
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
Danger
H300: Fatal if swallowed [Danger Acute toxicity, oral]
P262, P264, P270, P280, P301+P316, P302+P352, P316, P321, P330, P361+P364, P405, and P501 (click each P-code to see the statement)
Hazard information
Hazard Classes and CategoriesAcute toxicity (Oral) - Category 2
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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