1-Docosanol, 1-(hydrogen sulfate), calcium salt (2:1)
calcium docosyl sulfate
Also Known As: calcium docosyl sulfate|Calcium didocosyl bis(sulphate)|Calcium bis(docosyl sulfate)|1-Docosanol, hydrogen sulfate, calcium salt|Calcium didocosyl bis(sulfate)|Bis(docosyloxysulfonyloxy)calcium|C22H46O4S.1/2Ca|C22-H46-O4-S.1/2Ca|Sulfuric acid, monodocosyl ester, calcium salt|1-Docosanol, 1-(hydrogen sulfate), calcium salt (2:1)
CAS: 72018-25-8
| Molecular Formula | C44H90CaO8S2 |
|---|---|
| Molecular Weight | 850.5703 g/mol |
| LogP | 14.1894 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 42 |
| Exact Mass | 850.5703 |
| Monoisotopic Mass | 850.5703 |
| Heavy Atoms | 55 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 72018-25-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Ca+2] |
| InChIKey | PHIXWQJPNMQWFK-UHFFFAOYSA-L |
Product Overview
1-Docosanol, 1-(hydrogen sulfate), calcium salt (2:1) (CAS 72018-25-8), with molecular formula C44H90CaO8S2 and molecular weight 850.5703 g/mol. IUPAC: calcium docosyl sulfate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
1-Docosanol, 1-(hydrogen sulfate), calcium salt (2:1) is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »