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Home > Encyclopedia > 21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione

21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione

21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione structure

21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione 

structure
  • CAS No:

    37413-91-5

  • Formula:

    C23H26O4

  • Chemical Name:

    21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione

  • Synonyms:

    Pregna-1,4,9(11),16-tetraene-3,20-dione,21-(acetyloxy)-;Pregna-1,4,9(11),16-tetraene-3,20-dione,21-hydroxy-,acetate;21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione;21-Acetoxypregna-1,4,9(11),16-tetraene-3,20-dione;21-Hydroxy-1,4,9(11)-tetraene 21-acetate;2-((10S,13S,14S)-10,13-Dimethyl-3-oxo-6,7,8,10,12,13,14,15-octahydro-3H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate;3,20-Dioxopregna-1,4,9(11),16-tetraen-21-yl acetate

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

White Solid

21-(Acetyloxy)pregna-1,4,9(11),16-tetraene-3,20-dione Basic Attributes

366.450

366.45

253-497-3

DTXSID60190855

Characteristics

60.44000

3.48

1.2±0.1 g/cm3

172-174 °C @ Solvent: Methanol, Acetone

534.6±50.0 °C at 760 mmHg

233.0±30.2 °C

1.585

Safety Information

P201, P202, P264, P273, P280, P281, P302+P352, P308+P313, P321, P332+P313, P362, P391, P405, P501

H315

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P273, P280, P281, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P308+P313, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 10 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:366.4
XLogP3:3.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:366.18310931
Monoisotopic Mass:366.18310931
Topological Polar Surface Area:60.4
Heavy Atom Count:27
Complexity:856
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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