| CAS Number | 1483921-01-2 |
| Catalog Number | AG01B36Z |
| Chemical Name | 4-bromo-5-carbamoyl-2-fluorobenzene-1-sulfonyl chloride |
| IUPAC Name | 4-bromo-5-carbamoyl-2-fluorobenzenesulfonyl chloride |
| InChI | InChI=1S/C7H4BrClFNO3S/c8-4-2-5(10)6(15(9,13)14)1-3(4)7(11)12/h1-2H,(H2,11,12) |
| InChI Key | KJLCLHNURHAFEP-UHFFFAOYSA-N |
| MDL Number | MFCD21224377 |
| Molecular Formula | C7H4BrClFNO3S |
| Molecular Weight | 316.532 |
| SMILES | NC(C1=C(Br)C=C(F)C(S(Cl)(=O)=O)=C1)=O |
| Synonyms | 4-bromo-5-carbamoyl-2-fluorobenzene-1-sulfonyl chloride,
1483921-01-2,
AKOS014703906,
ZINC108311406,
FCH5162976,
BBV-40114380,
EN300-277589,
|
| Complexity | 358 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 314.877g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 316.525g/mol |
| Monoisotopic Mass | 314.877g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 85.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number