ST50299012
3-[3-(4-methylphenyl)sulfonyloxypropoxy]propyl 4-methylbenzenesulfonate
Also Known As: 4-oxaheptane-1,7-ditosylate|BAS 00104205|4-Oxaheptamethylene bis(p-toluenesulfonate)|AH-034/32828017|oxydipropane-3,1-diyl bis(4-methylbenzenesulfonate)|1-methyl-4-[3-[3-(4-methylphenyl)sulfonyloxypropoxy]propoxysulfonyl]benzene|3-(3-{[(4-METHYLPHENYL)SULFONYL]OXY}PROPOXY)PROPYL 4-METHYLBENZENESULFONATE|Oxydi(propane-3,1-diyl) bis(4-methylbenzene-1-sulfonate)|3-[3-(4-methylphenyl)sulfonyloxypropoxy]propyl 4-methylbenze|3-[3-(4-methylphenyl)sulfonyloxypropoxy]propyl 4-methylbenzenesulfonate|3-{3-[(4-methylphenyl)sulfonyloxy]propoxy}propyl 4-methylbenzenesulfonate|3-(3-([(4-Methylphenyl)sulfonyl]oxy)propoxy)propyl 4-methylbenzenesulfonate #|3-(3-{[(4-methylbenzene)sulfonyl]oxy}propoxy)propyl 4-methylbenzene-1-sulfonate|3-{3-[(4-methylbenzenesulfonyl)oxy]propoxy}propyl 4-methylbenzene-1-sulfonate
| Molecular Formula | C20H26O7S2 |
|---|---|
| Molecular Weight | 442.112 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 442.112 |
| Monoisotopic Mass | 442.112 |
| Heavy Atoms | 29 |
| Complexity | 590.0 |
Chemical Identifiers
| CAS Number | 55005-96-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCCOCCCOS(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | KHUGAMZTNKBNFW-UHFFFAOYSA-N |
Product Overview
ST50299012 (CAS 55005-96-4), with molecular formula C20H26O7S2 and molecular weight 442.112 g/mol. IUPAC: 3-[3-(4-methylphenyl)sulfonyloxypropoxy]propyl 4-methylbenzenesulfonate.