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861-83-6

861-83-6 Structure

861-83-6 Structure
IdentificationBack Directory
[Name]

Methyl Allocholate
[CAS]

861-83-6
[Synonyms]

Methyl Allocholate
Allocholic Acid Impurity 6
Cholan-24-oic acid, 3,7,12-trihydroxy-, methyl ester, (3α,5α,7α,12α)-
(R)-methyl 4-((3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate
[Molecular Formula]

C25H42O5
[MOL File]

861-83-6.mol
[Molecular Weight]

422.61
Chemical PropertiesBack Directory
[Melting point ]

225-226 °C
[Boiling point ]

541.6±50.0 °C(Predicted)
[density ]

1.141±0.06 g/cm3(Predicted)
[solubility ]

DCM, Methanol
[form ]

Solid
[pka]

14?+-.0.70(Predicted)
[color ]

White
Hazard InformationBack Directory
[Uses]

Methyl Allocholate is an intermediate in the synthesis of Allocholic Acid (A545000), a steroid bile acid found in animals.
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