Basic information
- CAS
330469-20-0- Standard SMILES
Cc1cc(Br)ccc1NC(=O)c1ccccc1F- InChIKey
CFHWPECZNCQHRJ-UHFFFAOYSA-N- Molecular formula
- C14H11BrFNO
- Average molar mass
- 308.14 g/mol
- Monoisotopic mass
- 307.0008
Names & identifiers
- Preferred name
- N-(4-bromo-2-methylphenyl)-2-fluorobenzamide
- IUPAC
- N-(4-bromo-2-methylphenyl)-2-fluorobenzamide
- English name
- N-(4-bromo-2-methylphenyl)-2-fluorobenzamide
- Molecular formula
- C14H11BrFNO
- Molecular weight
- 308.15
Names & synonyms
N-(4-bromo-2-methylphenyl)-2-fluorobenzamide330469-20-0starbld0003989Oprea1_389012Oprea1_551607DTXSID301258439STK039980AKOS000192219ST50695551AG-690/11635793N-(4-bromo-2-methylphenyl)(2-fluorophenyl)carboxamideZ26621810
Show more names
Benzamide, N-(4-bromo-2-methylphenyl)-2-fluoro-
Database identifiers
- CAS
330469-20-0- PubChem CID
- 798992
- DTXSID
DTXSID301258439
Properties
Computed structural properties
- XLogP
- 3.8
- 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
- 300
Physicochemical properties
- Boiling point
- 314.3 · 314.3±42.0 °C(Predicted)
- Density
- 1.503 · 1.503±0.06 g/cm3(Predicted)
- pka
- 11.78 · 11.78±0.70(Predicted)
Chemistry & industry
Suppliers3 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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