| CAS Number | 68800-33-9 |
| Catalog Number | AG005NZM(AGN-PC-022YOB) |
| Chemical Name | 2-Ethoxybenzene-1-sulfonyl chloride |
| IUPAC Name | 2-ethoxybenzenesulfonyl chloride |
| InChI | InChI=1S/C8H9ClO3S/c1-2-12-7-5-3-4-6-8(7)13(9,10)11/h3-6H,2H2,1H3 |
| InChI Key | RWURYJNJYODVAL-UHFFFAOYSA-N |
| MDL Number | MFCD08706420 |
| Molecular Formula | C8H9ClO3S |
| Molecular Weight | 220.6733 |
| SMILES | S(Cl)(=O)(=O)C1C=CC=CC=1OCC |
| Synonyms | 68800-33-9,
2-Ethoxybenzene-1-sulfonyl chloride,
2-ETHOXY-BENZENESULFONYL CHLORIDE,
2-ethoxybenzenesulfonyl chloride,
MFCD08706420,
SCHEMBL8726763,
CTK2F1788,
DTXSID00596731,
RWURYJNJYODVAL-UHFFFAOYSA-N,
Benzenesulfonylchloride, 2-ethoxy-,
STL302105,
ZINC97949410,
AKOS010077101,
MCULE-3963383093,
DB-074072,
FT-0747662,
ST24040529,
L-2336,
F2167-0062,
51223-59-7,
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| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.667g/mol |
| Monoisotopic Mass | 219.996g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number