| CAS Number | 53973-97-0 |
| Catalog Number | AG01AJ0Y |
| Chemical Name | 2-Methylnaphthalene-1-sulfonyl chloride |
| IUPAC Name | 2-methylnaphthalene-1-sulfonyl chloride |
| InChI | InChI=1S/C11H9ClO2S/c1-8-6-7-9-4-2-3-5-10(9)11(8)15(12,13)14/h2-7H,1H3 |
| InChI Key | KRTQHSSAPOINBY-UHFFFAOYSA-N |
| MDL Number | MFCD19200431 |
| Molecular Formula | C11H9ClO2S |
| Molecular Weight | 240.7060 |
| SMILES | CC1=C(S(Cl)(=O)=O)C2=C(C=CC=C2)C=C1 |
| Synonyms | 2-methylnaphthalene-1-sulfonyl chloride,
53973-97-0,
SCHEMBL2574159,
AKOS006335709,
ZINC100634700,
NE62104,
EN300-79516,
|
| Complexity | 320 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.701g/mol |
| Monoisotopic Mass | 240.001g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number