Dicirenone

CAS

41020-79-5

Catalog Number

ACM41020795

Category

Other Products

Molecular Weight

428.565

Molecular Formula

C₂₆H₃₆O₅

MSDS COA Spec Sheet

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Specification

Synonyms

Dicirenone;SC 26304;(17R)-17-Hydroxy-3-oxo-7α-(isopropyloxycarbonyl)pregn-4-ene-21-carboxylic acid γ-lactone

IUPAC Name

propan-2-yl (7R,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-3,5-dioxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2-oxolane]-7-carboxylate

Canonical SMILES

CC(C)OC(=O)C1CC2=CC(=O)CCC2(C3C1C4CCC5(C4(CC3)C)CCC(=O)O5)C

InChI Key

WUVPAYPBMZMHJO-IMNLCBETSA-N

Boiling Point

579.346ºC at 760 mmHg

Flash Point

248.372ºC

Density

1.187g/cm³

Exact Mass

428.25600

H-Bond Acceptor

H-Bond Donor

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