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Alfadione

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Alfadione

EINECS N/A
CAS No. 8067-82-1 Density N/A
PSA 135.04000 LogP 7.09160
Solubility N/A Melting Point N/A
Formula C23H34O5•C21H32O3 Boiling Point 523.6°C at 760 mmHg
Molecular Weight 723.10 Flash Point 175.1°C
Transport Information N/A Appearance N/A
Safety Poison by intravenous route in humans. Also poison by intraperitoneal route experimentally. When heated to decomposition it emits acrid smoke and fumes. Risk Codes N/A
Molecular Structure Molecular Structure of 8067-82-1 ((3R,5S,8S,9S,10S,13R,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3 ,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11- one: [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-hydroxy-10,13-dimethyl-11-oxo -1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthr en-17-yl]-2-oxo-ethyl] acetate) Hazard Symbols N/A
Synonyms

N/A

 

Alfadione Chemical Properties

IUPAC Name: (3R,5S,8S,9S,10S,13S,14S,17S)-17-Acetyl-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,
17-tetradecahydrocyclopenta[a]phenanthren-11-one ; [2-[(3R,5S,8S,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Molecular Formula: C23H34O5•C21H32O3
Molecular Weight: 723.10g/mol
 Freely Rotating Bonds: 5
Polar Surface Area: 69.67 Å2
Flash Point: 175.1 °C
Enthalpy of Vaporization: 91.74 kJ/mol
Boiling Point: 523.6 °C at 760 mmHg
Vapour Pressure: 3.75E-13 mmHg at 25°C 
The Cas Register Number of Alfadione is 8067-82-1 .The chemical synonyms of Alfadione (CAS No.8067-82-1) are (3R,5S,8S,9S,10S,13R,14S,17S)-17-Acetyl-3-hydroxy-10,13-dimethyl-1,2,3 ,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11- one ; [2-[(3R,5S,8S,9S,10S,13R,14S,17S)-3-Hydroxy-10,13-dimethyl-11-oxo -1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthr en-17-yl]-2-oxo-ethyl] acetate ; Alfaxalone alfadolone mixture .The molecular structure of Alfadione (CAS No.8067-82-1) is.

Alfadione Uses

It can be used in organic synthesis.

Alfadione Toxicity Data With Reference

1.    

ivnwmn LDLo:125 mg/kg

    PRACAK    Practitioner. 222 (1979),249.
2.    

ipr-rat LD50:79 mg/kg

    THERAP    Therapie. 32 (1977),375.
3.    

ivn-rat LD50:36 mg/kg

    JZKEDZ    Jitchuken, Zenrinsho Kenkyuho. Central Institute for Experimental Animals, Preclinical Reports. 1 (1975),119.
4.    

ipr-mus LD50:140 mg/kg

    JEMAAJ    Journal of the Egyptian Medical Association. 62 (1979),191.
5.    

ivn-mus LD50:47 mg/kg

    JEMAAJ    Journal of the Egyptian Medical Association. 62 (1979),191.
6.    

ivnrbt LD50:12,700 µg/kg

    PESTD5    Proceedings of the European Society of Toxicology. 16 (1975),208

Alfadione Safety Profile

Poison by intravenous route in humans. Also poison by intraperitoneal route experimentally. When heated to decomposition it emits acrid smoke and fumes.

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