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Home > Encyclopedia > (5α,11β)-11-[4-(Dimethylamino)phenyl]-5-hydroxy-estr-9-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal)

(5α,11β)-11-[4-(Dimethylamino)phenyl]-5-hydroxy-estr-9-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal)

(5α,11β)-11-[4-(Dimethylamino)phenyl]-5-hydroxy-estr-9-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal) structure

(5α,11β)-11-[4-(Dimethylamino)phenyl]-5-hydroxy-estr-9-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal) 

structure
  • CAS No:

    91934-77-9

  • Formula:

    C28H37NO4

  • Chemical Name:

    (5α,11β)-11-[4-(Dimethylamino)phenyl]-5-hydroxy-estr-9-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal)

  • Synonyms:

    SCHEMBL3174837;(5alpha,11beta)-11-[4-(Dimethylamino)phenyl]-5-hydroxy-estr-9-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal);(5"R,8"S,11"R,13"S,14"S)-11"-[4-(dimethylamino)phenyl]-5"-hydroxy-13"-methylspiro[1,3-dioxolane-2,3"-2,4,6,7,8,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17"-one

Description

White Solid

(5α,11β)-11-[4-(Dimethylamino)phenyl]-5-hydroxy-estr-9-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal) Basic Attributes

451.59768

451.272

Characteristics

59

2.3

1.24±0.1 g/cm3(Predicted)

(5α,11β)-11-[4-(Dimethylamino)phenyl]-5-hydroxy-estr-9-ene-3,17-dione Cyclic 3-(1,2-Ethanediyl Acetal) Use and Manufacturing

Intermediate in the preparation of Mifepristone metabolites.

Computed Properties

Molecular Weight:451.6
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:451.27225866
Monoisotopic Mass:451.27225866
Topological Polar Surface Area:59
Heavy Atom Count:33
Complexity:837
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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