| CAS Number | 3384-05-2 |
| Catalog Number | AG01ARY7(AGN-PC-0WCOIS) |
| Chemical Name | 3-Phenoxypropane-1-sulfonyl chloride |
| IUPAC Name | 3-phenoxypropane-1-sulfonyl chloride |
| InChI | InChI=1S/C9H11ClO3S/c10-14(11,12)8-4-7-13-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2 |
| InChI Key | KQQXONXRBRPWRN-UHFFFAOYSA-N |
| MDL Number | MFCD10022986 |
| Molecular Formula | C9H11ClO3S |
| Molecular Weight | 234.6998 |
| SMILES | O=S(Cl)(=O)CCCOC1=CC=CC=C1 |
| Synonyms | 3-phenoxypropane-1-sulfonyl chloride,
3384-05-2,
SCHEMBL20572659,
[3-(Chlorosulfonyl)propoxy]benzene,
AKOS012235375,
ZINC100495379,
MCULE-9369726752,
L-3080,
F9995-1784,
|
| Complexity | 239 |
| 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 | 5 |
| 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