| CAS Number | 1329280-50-3 |
| Catalog Number | AG009WX7(AGN-PC-0WNQW7) |
| Chemical Name | 3-Bromo-5-fluoro-N-propylbenzamide |
| IUPAC Name | 3-bromo-5-fluoro-N-propylbenzamide |
| InChI | InChI=1S/C10H11BrFNO/c1-2-3-13-10(14)7-4-8(11)6-9(12)5-7/h4-6H,2-3H2,1H3,(H,13,14) |
| InChI Key | FHCGRTFMUIQTPR-UHFFFAOYSA-N |
| MDL Number | MFCD19597015 |
| Molecular Formula | C10H11BrFNO |
| Molecular Weight | 260.1028 |
| SMILES | CCCNC(=O)c1cc(F)cc(c1)Br |
| Synonyms | 3-bromo-5-fluoro-N-propylbenzamide,
1329280-50-3,
ZINC46740874,
AKOS009472133,
Z9663,
C10H11BrFNO,
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| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.106g/mol |
| Monoisotopic Mass | 259.001g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number