| CAS Number | 98821-29-5 |
| Catalog Number | AG01E3T0(AGN-PC-0OOZLJ) |
| Chemical Name | (1E)-prop-1-ene-1-sulfonyl chloride |
| IUPAC Name | (E)-prop-1-ene-1-sulfonyl chloride |
| InChI | InChI=1S/C3H5ClO2S/c1-2-3-7(4,5)6/h2-3H,1H3/b3-2+ |
| InChI Key | GZYRNGLILQCDRQ-NSCUHMNNSA-N |
| MDL Number | MFCD19200072 |
| Molecular Formula | C3H5ClO2S |
| Molecular Weight | 140.5886 |
| SMILES | C/C=C/S(Cl)(=O)=O |
| Synonyms | prop-1-ene-1-sulfonyl chloride,
(1E)-prop-1-ene-1-sulfonyl chloride,
26226-45-9,
98821-29-5,
SCHEMBL1301029,
SCHEMBL1301030,
MFCD19200072,
AKOS006335116,
ZINC100451489,
NE47238,
BS-12771,
(1E)-prop-1-ene-1-sulfonyl chloride, E,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 139.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.581g/mol |
| Monoisotopic Mass | 139.97g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number