Determine the necessary mass, volume, or concentration for preparing a solution.
≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Information
Ecamsule.2Na is the Sodium salt form of Ecamsule. Ecamsule is an active ingredient of sunscreens that protects the skin from sunburn and erythema.
| ALogP | -0.638 |
|---|---|
| hba_count | 2 |
| Rotatable Bond | 6 |
| Canonical Smiles | CC1(C2CCC1(C(=O)C2=CC3=CC=C(C=C3)C=C4C5CCC(C4=O)(C5(C)C)CS(=O)(=O)[O-])CS(=O)(=O)[O-])C.[Na+].[Na+] |
|---|---|
| IUPAC Name | disodium;[3-[[4-[[7,7-dimethyl-3-oxo-4-(sulfonatomethyl)-2-bicyclo[2.2.1]heptanylidene]methyl]phenyl]methylidene]-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonate |
| InChIKey | ABZNEHKRFLKURR-UHFFFAOYSA-L |
| INCHI | 1S/C28H34O8S2.2Na/c1-25(2)21-9-11-27(25,15-37(31,32)33)23(29)19(21)13-17-5-7-18(8-6-17)14-20-22-10-12-28(24(20)30,26(22,3)4)16-38(34,35)36;;/h5-8,13-14,21-22H,9-12,15-16H2,1-4H3,(H,31,32,33)(H,34,35,36);;/q;2*+1/p-2 |
| Isomeric SMILES | CC1(C2CCC1(C(=O)C2=CC3=CC=C(C=C3)C=C4C5CCC(C4=O)(C5(C)C)CS(=O)(=O)[O-])CS(=O)(=O)[O-])C.[Na+].[Na+] |
| Molecular Weight | 606.66 |
| Reaxy-Rn | 31845050 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=31845050&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Apr 03, 2025 | E412986 | |
| Certificate of Analysis | Apr 03, 2025 | E412986 | |
| Certificate of Analysis | Apr 03, 2025 | E412986 | |
| Certificate of Analysis | Apr 03, 2025 | E412986 |
| Solubility | Solubility (25°C) In vitro DMSO: 100 mg/mL (164.83 mM); Water: 100 mg/mL (164.83 mM); Ethanol: Insoluble; |
|---|---|
| Sensitivity | Moisture sensitive |
| DMSO(mg / mL) Max Solubility | 100 |
| DMSO(mM) Max Solubility | 164.836976230508 |
| Water(mg / mL) Max Solubility | 100 |
| Water(mM) Max Solubility | 164.836976230508 |