2-[[(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxymethyl]-1,1-dioxo-1,2-benzothiazol-3-one

Names

[ CAS No. ]:
157231-19-1

[ Name ]:
2-[[(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxymethyl]-1,1-dioxo-1,2-benzothiazol-3-one

[Synonym ]:
2-(((17beta-Hydroxyestra-1,3,5(10)-trien-3-yl)oxy)methyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide
1,2-Benzisothiazol-3(2H)-one,2-((((17beta)-17-hydroxyestra-1,3,5(10)-trien-3-yl)oxy)methyl)-,1,1-dioxide

Chemical & Physical Properties

[ Density]:
1.347g/cm3

[ Boiling Point ]:
672.2ºC at 760mmHg

[ Molecular Formula ]:
C26H29NO5S

[ Molecular Weight ]:
467.57700

[ Flash Point ]:
360.4ºC

[ Exact Mass ]:
467.17700

[ PSA ]:
92.29000

[ LogP ]:
5.10330

[ Vapour Pressure ]:
5.47E-19mmHg at 25°C

[ Index of Refraction ]:
1.634

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • (R)-3,3-Dimethylcyclohexan-1-amine
  • (R)-2-Oxa-8-azaspiro[4.5]decan-4-ol
  • 1-(2-Methyl-tetrahydro-furan-3-yl)-piperazine
  • 2-(Oxan-4-yl)-2,7-diazaspiro[4.4]nonane
  • 1-(2,3-Dimethylcyclopentyl)piperazine
  • 1-(2,2,2-Trifluoroethyl)-4,5,6,7-tetrahydrotriazolo[4,5-c]pyridine
  • 4-(3-Ethylcyclopentyl)-2-piperazinone
  • 4-(1,1-Dimethyl-2-fluoroethyl)piperazine
  • 2-(tert-Butyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
  • 2-Bromo-1-(1,2,3,4-tetrahydro-4-isopropyl-1,1-dimethylnaphthalen-6-yl)ethanone
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