| CAS Number | 1193388-31-6 |
| Catalog Number | AG019W1R |
| Chemical Name | 2,6-Difluoro-4-nitrobenzene-1-sulfonyl chloride |
| IUPAC Name | 2,6-difluoro-4-nitrobenzenesulfonyl chloride |
| InChI | InChI=1S/C6H2ClF2NO4S/c7-15(13,14)6-4(8)1-3(10(11)12)2-5(6)9/h1-2H |
| InChI Key | XMTMCDJHARJFGE-UHFFFAOYSA-N |
| MDL Number | MFCD12912812 |
| Molecular Formula | C6H2ClF2NO4S |
| Molecular Weight | 257.5992 |
| SMILES | FC1=C(C(=CC(=C1)[N+](=O)[O-])F)S(=O)(=O)Cl |
| Synonyms | 2,6-difluoro-4-nitrobenzene-1-sulfonyl chloride,
1193388-31-6,
AC1Q1XCS,
CTK5I2780,
ZINC100585732,
NE30609,
EN300-50183,
|
| Complexity | 339 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.936g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.592g/mol |
| Monoisotopic Mass | 256.936g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 88.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number