(8S,9S,13S,14S)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-2,17-diol

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Names

[ CAS No. ]:
26011-40-5

[ Name ]:
(8S,9S,13S,14S)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-2,17-diol

[Synonym ]:
17|A-Ethynyl-2-hydroxyestradiol 3-Methyl Ether
2-Hydroxy Mestranol
19-Nor-17a-pregna-1,3,5(10)-trien-20-yne-2,17-diol,3-methoxy-(8CI)
(17|A)-3-Methoxy-19-norpregna-1,3,5(10)-trien-20-yne-2,17-diol

Chemical & Physical Properties

[ Density]:
1.22g/cm3

[ Boiling Point ]:
476ºC at 760 mmHg

[ Molecular Formula ]:
C21H26O3

[ Molecular Weight ]:
326.42900

[ Flash Point ]:
241.7ºC

[ Exact Mass ]:
326.18800

[ PSA ]:
49.69000

[ LogP ]:
3.62120

[ Vapour Pressure ]:
7.21E-10mmHg at 25°C

[ Index of Refraction ]:
1.612

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RC8944200
CHEMICAL NAME :
19-Nor-17-alpha-pregna-1,3,5(10)-trien-20-yne-2,17-di ol, 3-methoxy-
CAS REGISTRY NUMBER :
26011-40-5
LAST UPDATED :
198910
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H26-O3
MOLECULAR WEIGHT :
326.47

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
30 mg/kg
SEX/DURATION :
female 1-6 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants)
REFERENCE :
STEDAM Steroids. (Holden-Day Inc., 4432 Telegraph Ave., Oakland, CA 94609) V.1- 1963- Volume(issue)/page/year: 30,343,1977