Basic information
- Name:
Allylestrenol
- CAS No.:
432-60-0
- Molecular Structure:
- Formula:
- C21H32O
- Synonyms:
- Estr-4-en-17-ol,17-(2-propenyl)-, (17b)- (9CI);Estr-4-en-17b-ol, 17-allyl- (6CI,8CI);17a-Allyl-17b-hydroxy-D4-estren;17a-Allyl-4-oestren-17b-ol;17a-Allylestr-4-en-17b-ol;17a-Allylestrenol;Gestanin;Gestanol;Gestanon;NSC 37723;Orageston;Turinal;Estr-4-en-17-ol,17-(2-propen-1-yl)-, (17b)-;
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Chemistry
Molecular Structure of Allylestrenol (CAS NO.432-60-0):
.jpg)
IUPAC Name: (8R,9S,10R,13S,14S,17R)-13-Methyl-17-prop-2-enyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
Molecular Weight: 300.47818 [g/mol]
Molecular Formula: C21H32O
XLogP3-AA: 5.3
H-Bond Donor: 1
H-Bond Acceptor: 1
EINECS: 207-082-9
Product Categories: Medicine intermediate
Index of Refraction: 1.552
Molar Refractivity: 92.02 cm3
Molar Volume: 287.7 cm3
Surface Tension: 40.8 dyne/cm
Density: 1.04 g/cm3
Flash Point: 170.6 °C
Enthalpy of Vaporization: 75.92 kJ/mol
Boiling Point: 405.4 °C at 760 mmHg
Vapour Pressure: 2.92E-08 mmHg at 25 °C
Appearance: white crystalline powder
Melting Point: 80 °C
Classification Code: Hormone; Hormones; Hormones, Hormone Substitutes, and Hormone Antagonists; Human Data; Progestins; Reproductive Effect
Uses
Allylestrenol (CAS NO.432-60-0) can be used as pharmaceutical raw material and intermediates reagent.
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | oral | > 640mg/kg (640mg/kg) | Drugs in Japan Vol. 6, Pg. 41, 1982. |
Safety Profile
Human reproductive effects. An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits acrid smoke and irritating fumes.
Specification
Allylestrenol (CAS NO.432-60-0), its Synonyms are 17-(2-Propenyl)estr-4-en-17-ol ; 17-Hydroxy-17-alpha-allyl-4-estrene ; 17-alpha-Allyl-17-beta-hydroxy-4-estrene ; 17-alpha-Allyl-17-beta-hydroxy-delta(sup 4)-estren ; 17-alpha-Allyl-3-deoxy-19-nortestosterone ; 17-alpha-Allyl-4-oestrene-17-beta-ol ; 19-Nor-17-alpha-preg-4-en-17-ol, 21-methylene- ; 21-Methylene-19-nor-17-alpha-preg-4-en-17-ol ; 3-Deoxy-17-alpha-allyl-19-nortestosterone ; Allylestrenolum ; Estrenol, allyl- ; Gestanin ; Organon ; Turinal .
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