| CAS Number | 191043-81-9 |
| Catalog Number | AG00I2TV(AGN-PC-0CBORC) |
| Chemical Name | N-(4-Bromophenyl)-N-(methylsulfonyl)methanesulfonamide |
| IUPAC Name | N-(4-bromophenyl)-N-methylsulfonylmethanesulfonamide |
| InChI | InChI=1S/C8H10BrNO4S2/c1-15(11,12)10(16(2,13)14)8-5-3-7(9)4-6-8/h3-6H,1-2H3 |
| InChI Key | GAXUHSBRYMSLDD-UHFFFAOYSA-N |
| MDL Number | MFCD27946748 |
| Molecular Formula | C8H10BrNO4S2 |
| Molecular Weight | 328.2033 |
| SMILES | Brc1ccc(cc1)N(S(=O)(=O)C)S(=O)(=O)C |
| Synonyms | 191043-81-9,
N-(4-bromophenyl)-N-(methylsulfonyl)methanesulfonamide,
Methanesulfonamide, N-(4-bromophenyl)-N-(methylsulfonyl)-,
SCHEMBL1899321,
GAXUHSBRYMSLDD-UHFFFAOYSA-N,
ADAL1052118,
AKOS027439368,
ZINC117467439,
N-(Methylsulfonyl)-N-(4-bromophenyl)methanesulfonamide,
N-(4-BROMOPHENYL)-N-METHANESULFONYLMETHANESULFONAMIDE,
|
| Complexity | 394 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 326.923g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 328.195g/mol |
| Monoisotopic Mass | 326.923g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 88.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number