| CAS Number | 74616-28-7 |
| Catalog Number | AG00FX1C(AGN-PC-0WO2NG) |
| Chemical Name | 4,5-Dimethylthiophene-2-sulfonyl chloride |
| IUPAC Name | 4,5-dimethylthiophene-2-sulfonyl chloride |
| InChI | InChI=1S/C6H7ClO2S2/c1-4-3-6(10-5(4)2)11(7,8)9/h3H,1-2H3 |
| InChI Key | FYJYATBLABVTJO-UHFFFAOYSA-N |
| MDL Number | MFCD19200870 |
| Molecular Formula | C6H7ClO2S2 |
| Molecular Weight | 210.7016 |
| SMILES | CC1=C(C)SC(S(Cl)(=O)=O)=C1 |
| Synonyms | 4,5-dimethylthiophene-2-sulfonyl chloride,
4,5-dimethyl-2-Thiophenesulfonyl chloride,
74616-28-7,
SCHEMBL11048852,
AKOS006336017,
ZINC100656157,
NE53725,
DB-074857,
FT-0758613,
|
| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.958g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.69g/mol |
| Monoisotopic Mass | 209.958g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 70.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number