| CAS Number | 13982-84-8 |
| Catalog Number | AG009FIW(AGN-PC-0WO4IM) |
| Chemical Name | 4-Methylquinoline-8-sulfonyl chloride |
| IUPAC Name | 4-methylquinoline-8-sulfonyl chloride |
| InChI | InChI=1S/C10H8ClNO2S/c1-7-5-6-12-10-8(7)3-2-4-9(10)15(11,13)14/h2-6H,1H3 |
| InChI Key | PLMPTIQXJBKZAC-UHFFFAOYSA-N |
| MDL Number | MFCD18791269 |
| Molecular Formula | C10H8ClNO2S |
| Molecular Weight | 241.6940 |
| SMILES | CC1=C2C(C(S(Cl)(=O)=O)=CC=C2)=NC=C1 |
| Synonyms | 4-methylquinoline-8-sulfonyl chloride,
13982-84-8,
8-Quinolinesulfonyl chloride, 4-methyl-,
SCHEMBL16569698,
PLMPTIQXJBKZAC-UHFFFAOYSA-N,
AKOS006334576,
ZINC100132510,
NE51930,
AM805641,
SC-87155,
EN300-79490,
4-METHYL-QUINOLINE-8-SULFONYL CHLORIDE,
4-Methyl-8-quinoxalinesulfonyl Chloride,
|
| Complexity | 325 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.689g/mol |
| Monoisotopic Mass | 240.996g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number