| CAS Number | 749927-82-0 |
| Catalog Number | AG008OEF(AGN-PC-04PDFF) |
| Chemical Name | Ethyl 4-bromo-2-fluorobenzamide |
| IUPAC Name | 4-bromo-N-ethyl-2-fluorobenzamide |
| InChI | InChI=1S/C9H9BrFNO/c1-2-12-9(13)7-4-3-6(10)5-8(7)11/h3-5H,2H2,1H3,(H,12,13) |
| InChI Key | WRCAXTFEUQRZDZ-UHFFFAOYSA-N |
| MDL Number | MFCD09928893 |
| Molecular Formula | C9H9BrFNO |
| Molecular Weight | 246.0763 |
| SMILES | CCNC(=O)c1ccc(cc1F)Br |
| Synonyms | 4-Bromo-N-ethyl-2-fluorobenzamide,
749927-82-0,
ETHYL 4-BROMO-2-FLUOROBENZAMIDE,
ACMC-209owt,
SCHEMBL3346723,
CTK5E0861,
DTXSID50640738,
WRCAXTFEUQRZDZ-UHFFFAOYSA-N,
4-Bromo-2-fluoro-N-ethylbenzamide,
4-bromo-N-ethyl-2-fluoro-benzamide,
ANW-36555,
MFCD09928893,
ZINC19425663,
AKOS000167182,
AJ-73430,
CJ-16143,
TR-037664,
V7602,
B-4730,
I01-10912,
C9H9BrFNO,
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| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.079g/mol |
| Monoisotopic Mass | 244.985g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number