2-fluoro-N-(4-fluorophenyl)benzamide
Basic information
- CAS
294849-21-1- Standard SMILES
O=C(Nc1ccc(F)cc1)c1ccccc1F- InChIKey
YSRSFSHRXSKXNN-UHFFFAOYSA-N- Molecular formula
- C13H9F2NO
- Average molar mass
- 233.21 g/mol
- Monoisotopic mass
- 233.06522023
Names & identifiers
- Preferred name
- 2-fluoro-N-(4-fluorophenyl)benzamide
- IUPAC
- 2-fluoro-N-(4-fluorophenyl)benzamide
- English name
- 2-fluoro-N-(4-fluorophenyl)benzamide
- Molecular formula
- C13H9F2NO
- Molecular weight
- 233.21
Names & synonyms
2-fluoro-N-(4-fluorophenyl)benzamide294849-21-1DTXSID50336285RefChem:261074DTXCID002873742-fluoro-N-(4-fluorophenyl)benzenecarboxamideBenzamide, 2-fluoro-N-(4-fluorophenyl)-MFCD00439086Benzamide, N-(4-fluorophenyl)-2-fluoro-Cambridge id 5136696MLS000532707SCHEMBL6295702
Show more names
CHEMBL1530397SCHEMBL30739608YSRSFSHRXSKXNN-UHFFFAOYSA-NHMS2499F14AKOS002958704MS-00435136-69-6SMR000140145
Database identifiers
- CAS
294849-21-1- PubChem CID
- 531933
- DTXSID
DTXSID50336285- ChEMBL
CHEMBL1530397
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Melting point
- 117.1 °C · 117.1 °C
- Boiling point
- 255.7 · 255.7±25.0 °C(Predicted)
- Density
- 1.319 · 1.319±0.06 g/cm3(Predicted)
- pka
- 11.63 · 11.63±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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