| CAS Number | 17970-75-1 |
| Catalog Number | AG019XE8 |
| Chemical Name | 2-Chloro-6-nitrobenzene-1-sulfonyl chloride |
| IUPAC Name | 2-chloro-6-nitrobenzenesulfonyl chloride |
| InChI | InChI=1S/C6H3Cl2NO4S/c7-4-2-1-3-5(9(10)11)6(4)14(8,12)13/h1-3H |
| InChI Key | BSTJKQQPWQCPLP-UHFFFAOYSA-N |
| MDL Number | MFCD13196132 |
| Molecular Formula | C6H3Cl2NO4S |
| Molecular Weight | 256.0633 |
| SMILES | [O-][N+](C1=C(S(Cl)(=O)=O)C(Cl)=CC=C1)=O |
| Synonyms | 2-chloro-6-nitrobenzene-1-sulfonyl chloride,
17970-75-1,
2-chloro-6-nitro-benzenesulfonyl chloride,
AC1Q1WU0,
SCHEMBL7391512,
CTK5I3836,
ZINC100595622,
NE26060,
EN300-54778,
|
| Complexity | 320 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.916g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.053g/mol |
| Monoisotopic Mass | 254.916g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 88.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number