Basic information
- CAS
56661-24-6- Standard SMILES
O=C(Nc1ccc(Br)c(C(F)(F)F)c1)c1ccc(Br)cc1- InChIKey
WBNIDCAFRBXNPJ-UHFFFAOYSA-N- Molecular formula
- C14H8Br2F3NO
- Average molar mass
- 423.02 g/mol
- Monoisotopic mass
- 420.89247
Names & identifiers
- Preferred name
- 4-bromo-N-[4-bromo-3-(trifluoromethyl)phenyl]benzamide
- IUPAC
- 4-bromo-N-[4-bromo-3-(trifluoromethyl)phenyl]benzamide
Names & synonyms
4-bromo-N-[4-bromo-3-(trifluoromethyl)phenyl]benzamide56661-24-6DTXSID80404244Benzamide, 4-bromo-N-[4-bromo-3-(trifluoromethyl)phenyl]-AKOS001584938EU-0034373SR-01000396442SR-01000396442-1
Database identifiers
- CAS
56661-24-6- PubChem CID
- 4558477
- DTXSID
DTXSID80404244
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 370
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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