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

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Names

[ CAS No. ]:
7548-46-1

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

[Synonym ]:
bdh-6140

Chemical & Physical Properties

[ Density]:
1.31g/cm3

[ Boiling Point ]:
481.5ºC at 760 mmHg

[ Molecular Formula ]:
C22H27BrO2

[ Molecular Weight ]:
403.35300

[ Flash Point ]:
201ºC

[ Exact Mass ]:
402.11900

[ PSA ]:
18.46000

[ LogP ]:
5.29230

[ Index of Refraction ]:
1.594

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RC8924700
CHEMICAL NAME :
19-Nor-17-alpha-pregna-1,3,5(10)-trien-20-yne, 21-bromo-3,17-dimethoxy-
CAS REGISTRY NUMBER :
7548-46-1
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C22-H27-Br-O2
MOLECULAR WEIGHT :
403.40

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
1500 ug/kg
SEX/DURATION :
female 1-5 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated)
REFERENCE :
ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 53,443,1966
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
24 ug/kg
SEX/DURATION :
female 3 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - uterus, cervix, vagina
REFERENCE :
ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 53,443,1966
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
180 ug/kg
SEX/DURATION :
female 1-5 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated)
REFERENCE :
ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 53,443,1966
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
36300 ng/kg
SEX/DURATION :
female 3 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - uterus, cervix, vagina
REFERENCE :
ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 53,443,1966

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 4-(3-Fluoropyrrolidin-1-yl)thiophene-2-carbaldehyde
  • Methyl 3-(2-methylpyrrolidin-3-yl)prop-2-ynoate
  • 4-(1H-pyrazol-1-yl)pent-2-ynoic acid
  • Tert-butyl 6-(hydroxyimino)-2-azaspiro[3.3]heptane-2-carboxylate
  • (E)-Methyl 3-(2-iodophenoxy)acrylate
  • 2-(1-Ethynylcyclopropyl)naphthalene
  • 2-(1,1-Dioxo-1lambda6-thietan-3-yl)ethane-1-sulfinamide
  • 2,2,6,6-Tetramethyl-4-[3-(trimethylammonio)propoxy]-1-piperidinyloxy
  • 3-(Oxan-4-yl)propane-1-sulfinyl chloride
  • Tert-butyl (1r,3r)-3-(chlorosulfinyl)cyclobutane-1-carboxylate
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