CAS Number61510-09-6
Synonyms(3β)-Cholest-5-en-3-yl docosanoate; Docosanoic acid, (3β)-cholest-5-en-3-yl ester; Cholesteryl behenate; 22:0-cholesterol; 3beta-Hydroxy-5-cholestene 3-docosanoate; Cholesterol,docosanoate; cholest-5-en-3beta-yl docosanoate; MFCD00056440; Cholesterylbehenat; 5-Cholesten-3beta-ol 3-docosanoate; Cholesteryl docosanoate
Molecular FormulaC49H88O2
Molecular Weight709.222
Purity98.00%
Density0.9±0.1 g/cm3
Boiling Point711.0±39.0 °C at 760 mmHg
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 61510-09-6 |
| Catalog No. | 2A-9045506 |
| Chinese Name | 胆固醇山酸酯 |
| Synonyms | (3β)-Cholest-5-en-3-yl docosanoate; Docosanoic acid, (3β)-cholest-5-en-3-yl ester; Cholesteryl behenate; 22:0-cholesterol; 3beta-Hydroxy-5-cholestene 3-docosanoate; Cholesterol,docosanoate; cholest-5-en-3beta-yl docosanoate; MFCD00056440; Cholesterylbehenat; 5-Cholesten-3beta-ol 3-docosanoate; Cholesteryl docosanoate |
| Molecular Formula | C49H88O2 |
| Molecular Weight | 709.222 |
| Purity | 98.00 |
| Density | 0.9±0.1 g/cm3 |
| Boiling Point | 711.0±39.0 °C at 760 mmHg |
| Storage Condition | 2-8℃ |
| Application | Cholesteryl behenate is a standard in electrospray ionization tandem mass spectrometry for the analysis of cholesterol and cholesteryl esters. |
| PubChem ID | 24702212 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCCC(C)C)CCC32)C1 |
| InChI | InChI=1S/C49H88O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-47(50)51-42-34-36-48(5)41(38-42)30-31-43-45-33-32-44(40(4)28-26-27-39(2)3)49(45,6)37-35-46(43)48/h30,39-40,42-46H,7-29,31-38H2,1-6H3/t40-,42+,43+,44-,45+,46+,48+,49-/m1/s1 |
| InChI Key | WBOQXYUYHINMOC-FTAWAYKBSA-N |
| Hazard Symbols | transportation |
| Bioactivity | Cholesteryl behenate is a standard in electrospray ionization tandem mass spectrometry for the analysis of cholesterol and cholesteryl esters. Related Catalog Natural Products >> Others Research Areas >> Metabolic Disease Target Human Endogenous Metabolite Chemical & Physical Properties Density 0.9±0.1 g/cm3 Boiling Point 711.0±39.0 °C at 760 mmHg Molecular Formula C49H88O2 Molecular Weight 709.222 Flash Point 385.1±14.6 °C Exact Mass 708.678406 PSA 26.30000 LogP 21.33 Vapour Pressure 0.0±2.3 mmHg at 25°C Index of Refraction 1.504 InChIKey WBOQXYUYHINMOC-FTAWAYKBSA-N SMILES CCCCCCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCCC(C)C)CCC32)C1 Storage condition 2-8℃ |
| Use of | Cholesteryl behenate is a standard in electrospray ionization tandem mass spectrometry for the analysis of cholesterol and cholesteryl esters. Properties Name cholesteryl behenate Synonym More Synonyms Cholesteryl behenate Biological Activity Description Cholesteryl behenate is a standard in electrospray ionization tandem mass spectrometry for the analysis of cholesterol and cholesteryl esters. Related Catalog Natural Products >> Others Research Areas >> Metabolic Disease Human Endogenous Metabolite Chemical & Physical Properties Molecular Formula C49H88O2 Exact Mass 708.678406 PSA 26.30000 LogP 21.33 Index of Refraction 1.504 InChIKey WBOQXYUYHINMOC-FTAWAYKBSA-N Storage condition 2-8℃ |
| Transport Info | Product name: Purity: 99.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available |
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