ChemicalBook--->CAS DataBase List--->566-88-1

566-88-1

566-88-1 Structure

566-88-1 Structure
IdentificationBack Directory
[Name]

5ALPHA-CHOLESTAN-3-ONE
[CAS]

566-88-1
[Synonyms]

ZK-46023
CHOLESTANONE
CHOLESTAN-3-ONE
5A-CHOLESTAN-3-ONE
5à-cholestan-3-one
5α-Cholestan-3-one
CHOLESTAN-3-ONE(RG)
5alpha-Cholestanone
3-Keto-5α-cholestane
5ALPHA-CHOLESTAN-3-ONE
5alpha-Cholestane-3-one
Cholestanone, (5alpha)-
5ɑ-Cholestan-3-one, 97%
3-KETO-5ALPHA-CHOLESTANE
Cholestan-3-one, (5alpha)-
5A-CHOLESTAN-3-ONE CRYSTALLINE
10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-t etradecahydrocyclopenta[a]phenanthren-3-one
(5S,8R,9S,10S,13R,14S,17R)-10,13-diMethyl-17-((R)-6-Methylheptan-2-yl)tetradecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one
[Molecular Formula]

C27H46O
[MDL Number]

MFCD00065901
[MOL File]

566-88-1.mol
[Molecular Weight]

386.65
Chemical PropertiesBack Directory
[Appearance]

white fine crystalline powder or needles
[Melting point ]

128-133 °C
[alpha ]

[α]D20 +40~+44° (c=1, CHCl3)
[Boiling point ]

452.9±13.0 °C(Predicted)
[density ]

0.953
[storage temp. ]

Refrigerator
[solubility ]

Chloroform (Sparingly)
[form ]

crystalline
[color ]

White to Off-White
[Water Solubility ]

Insoluble in water.
[BRN ]

2625580
[InChIKey]

PESKGJQREUXSRR-UXIWKSIVSA-N
[SMILES]

[H][C@@]12CC[C@@]3([H])[C@]4([H])CC[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CCC(=O)C2
Hazard InformationBack Directory
[Chemical Properties]

white fine crystalline powder or needles
[Uses]

It is employed as a intermediate for organic synthesis.
[Definition]

ChEBI: 5alpha-cholestan-3-one is a 3-oxo-5alpha- steroid that is 5alpha-cholestane substituted by an oxo group at position 3. It has a role as a mammalian metabolite. It is a 3-oxo-5alpha-steroid and a 3-oxocholestane. It derives from a hydride of a 5alpha-cholestane.
Safety DataBack Directory
[Safety Statements ]

24/25
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Spectrum DetailBack Directory
[Spectrum Detail]

5ALPHA-CHOLESTAN-3-ONE(566-88-1)MS
5ALPHA-CHOLESTAN-3-ONE(566-88-1)1HNMR
5ALPHA-CHOLESTAN-3-ONE(566-88-1)13CNMR
5ALPHA-CHOLESTAN-3-ONE(566-88-1)IR1
5ALPHA-CHOLESTAN-3-ONE(566-88-1)IR2
5ALPHA-CHOLESTAN-3-ONE(566-88-1)Raman
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