| CAS Number | 3383-76-4 |
| Catalog Number | AG00C8OD(AGN-PC-08YY9T) |
| Chemical Name | 2-(4-Methylphenoxy)ethanesulfonyl chloride |
| IUPAC Name | 2-(4-methylphenoxy)ethanesulfonyl chloride |
| InChI | InChI=1S/C9H11ClO3S/c1-8-2-4-9(5-3-8)13-6-7-14(10,11)12/h2-5H,6-7H2,1H3 |
| InChI Key | LPFWKKSPCKBGON-UHFFFAOYSA-N |
| MDL Number | MFCD10022930 |
| Molecular Formula | C9H11ClO3S |
| Molecular Weight | 234.6998 |
| SMILES | S(Cl)(=O)(=O)CCOC1=CC=C(C=C1)C |
| Synonyms | 2-(4-METHYLPHENOXY)ETHANESULFONYL CHLORIDE,
3383-76-4,
2-(p-Tolyloxy)ethanesulfonyl chloride,
chloro[2-(4-methylphenoxy)ethyl]sulfone,
ALBB-024702,
ZX-CM009390,
MFCD10022930,
SBB072092,
AKOS013501628,
ZINC100153518,
MCULE-5135607921,
VS-0355,
BBV-38366541,
ST45027440,
2-(4-methylphenoxy)ethane-1-sulfonyl chloride,
Ethanesulfonyl chloride, 2-(4-methylphenoxy)-,
Y-6304,
2-(4-methylphenoxy)ethanesulfonyl chloride(SALTDATA,
|
| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.694g/mol |
| Monoisotopic Mass | 234.012g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number