3β-(Benzoyloxy)cholest-5-en-7-one

CAS
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CAS
6997-41-7
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Purity
96%
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Catalog Number

ACM6997417

Product Name

3β-(Benzoyloxy)cholest-5-en-7-one

Structure

CAS

6997-41-7

Category

Heterocyclic Organic Compound

Synonyms

3β-Hydroxy-cholest-5-en-7-one Benzoate;

IUPAC Name

[(3S,8S,9S,10R,13R,14S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-7-oxo-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] benzoate

Molecular Weight

504.74

Molecular Formula

C₃₄H₄₈O₃

Canonical SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2C(=O)C=C4C3(CCC(C4)OC(=O)C5=CC=CC=C5)C)C

InChI Key

CSZVQZAYIQQOMB-XOHJBGAPSA-N

Boiling Point

596.285ºC at 760 mmHg

Melting Point

159-160ºC

Flash Point

247.417ºC

Density

1.078g/cm³

Appearance

White Solid

Exact Mass

504.36000

H-Bond Acceptor

H-Bond Donor

MSDS

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COA

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Spec Sheet

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