| CAS Number | 933585-20-7 |
| Catalog Number | AG00GUTN(AGN-PC-0WNN9A) |
| Chemical Name | 3-Bromo-5-fluorobenzamide |
| EC Number | 618-926-4 |
| IUPAC Name | 3-bromo-5-fluorobenzamide |
| InChI | InChI=1S/C7H5BrFNO/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H2,10,11) |
| InChI Key | CFWMRENFPXKUBG-UHFFFAOYSA-N |
| MDL Number | MFCD07780673 |
| Molecular Formula | C7H5BrFNO |
| Molecular Weight | 218.0231 |
| SMILES | BrC=1C=C(C(=O)N)C=C(C1)F |
| Synonyms | 3-BROMO-5-FLUOROBENZAMIDE,
933585-20-7,
SCHEMBL12607365,
CTK5H2348,
KS-00003TKQ,
DTXSID70655783,
MFCD07780673,
ZINC28278284,
AKOS009396979,
AS03286,
QC-7896,
SC-42310,
TS-03117,
Z458888944,
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| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.954g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.025g/mol |
| Monoisotopic Mass | 216.954g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number