N-(3-chloro-4-methylphenyl)-4-fluorobenzamide
Basic information
- CAS
330469-22-2- Standard SMILES
Cc1ccc(NC(=O)c2ccc(F)cc2)cc1Cl- InChIKey
HPUUMOIZAZANCN-UHFFFAOYSA-N- Molecular formula
- C14H11ClFNO
- Average molar mass
- 263.69 g/mol
- Monoisotopic mass
- 263.0513198
Names & identifiers
- Preferred name
- N-(3-chloro-4-methylphenyl)-4-fluorobenzamide
- IUPAC
- N-(3-chloro-4-methylphenyl)-4-fluorobenzamide
- English name
- N-(3-chloro-4-methylphenyl)-4-fluorobenzamide
- Molecular formula
- C14H11ClFNO
- Molecular weight
- 263.69
Names & synonyms
N-(3-chloro-4-methylphenyl)-4-fluorobenzamide330469-22-2SCHEMBL12443604DTXSID401250890STK033334AKOS001296237DA-06828ST042793AG-690/11635803Z28153700N-(3-chloro-4-methylphenyl)(4-fluorophenyl)carboxamideBenzamide, N-(3-chloro-4-methylphenyl)-4-fluoro-
Database identifiers
- CAS
330469-22-2- PubChem CID
- 669208
- DTXSID
DTXSID401250890
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 292
Physicochemical properties
- Boiling point
- 302.8 · 302.8±42.0 °C(Predicted)
- Density
- 1.313 · 1.313±0.06 g/cm3(Predicted)
- pka
- 12.73 · 12.73±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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