(1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene | CAS No. 112670-85-6

(1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene

Basic Information

CAS Number

112670-85-6

Molecular Formula

C39H72O2Si2

Molecular Weight

629.18 g/mol

AD

Basic Physical Properties

Boiling Point

598.8±50.0 °C(Predicted)

Density

0.92

Flash Point

598.8 °C at 760 mmHg

Refractive Index

1.491

CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C

InChI

InChI=1S/C39H72O2Si2/c1-28(2)18-16-19-29(3)34-23-24-35-31(20-17-25-39(34,35)11)21-22-32-26-33(40-42(12,13)37(5,6)7)27-36(30(32)4)41-43(14,15)38(8,9)10/h21-22,28-29,33-36H,4,16-20,23-27H2,1-3,5-15H3/b31-21+,32-22-/t29-,33-,34-,35+,36+,39-/m1/s1

InChIKey

YYGPOUVOBLNWHS-XLQSZZCKSA-N

LogP

12.64879999999998

Topological Polar Surface Area

18.46 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

1020

Synonyms & References

English

  • AC-26373
  • Silane,[[(1a,3b,5E,7E)-9,10-secocholesta-5,7,10(19)-triene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethyl-
  • 1H-Indene, 4-[(2E)-2-[(3S,5R)-3,5-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2- methylenecyclohexylidene]ethylidene]-1-[(1R)-1,5-dimethylhexyl]octahydro-7a-methy)-(1R,3aS,4E,7aR)-
  • AKOS025401849
  • CS-13800
  • [(1S,3E,5R)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-5-[tert-butyl(dimethyl)silyl]oxy-2-methylidenecyclohexyl]oxy-tert-butyl-dimethylsilane
  • ((1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-7a-methyl-1-((R)-6-methylheptan-2-yl)dihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy)bis(tert-butyldimethylsilane)
  • [[(1a,3b,5e,7e)-9,10-secocholesta-5,7,10(19)-triene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethylsilane]
  • 1,3-bi-TBS-trans-Alfacalcidol
  • 112670-85-6
  • CS-M1124
  • 1H-Indene, 4-[(2E)-2-[(3S,5R)-3,5-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-methylenecyclohexylidene]ethylidene]-1-[(1R)-1,5-dimethylhexyl]octahydro-7a-methyl-, (1R,3aS,4E,7aR)-
  • (1R,3aS,4E,7aR)-4-[(2E)-2-[(3S,5R)-3,5-Bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-methylenecyclohexylidene]ethylidene]-1-[(1R)-1,5-dimethylhexyl]octahydro-7a-methyl-1H-indene
  • [[(1a,3b,5E,7E)-9,10-Secocholesta-5,7,10(19)-triene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethylsilane]
  • Alfacalcidol Impurity 7
  • ((1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-7a-Methyl-1-((R)-6-Methylheptan-2-yl)dihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-Methylenecyclohexane-1,3-diyl)bis(oxy)bis(tert-butyldiMethylsilane)
  • ((1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-7a-methyl-1-((R)-6-methylheptan-2-yl)dihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy)bis...
  • [(1a,3b,5E,7E)-9,10-Secocholesta-5,7,10(19)-triene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethylsilane]
  • [3-[2-[(3As,7aR)-7a-methyl-1-(6-methylheptan-2-yl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylid
  • CID 138108428

MDL Number

MFCD11977659

FAQ

What is (1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene (CAS: 112670-85-6)?

(1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene is a synthetic steroidal compound. It is a complex molecule with a unique structure that includes silyl ether groups and a specific carbon skeleton. This compound is not found in nature but can be synthesized in the laboratory for various applications.

What are the main uses of (1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene (CAS: 112670-85-6)?

(1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene is primarily used in pharmaceutical research as a model compound to study steroidal structures. It can also be utilized in organic synthesis as a precursor for other steroidal derivatives.

Is (1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene (CAS: 112670-85-6) safe?

The safety of (1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene (CAS: 112670-85-6) depends on the context of its use. It is not considered hazardous under normal laboratory conditions but should be handled with care to avoid skin contact and inhalation. Proper ventilation and personal protective equipment are recommended.

How should (1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene (CAS: 112670-85-6) be stored?

(1S,3R,5Z,7E)-1,3-Bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-9,10-secocholesta-5,7,10-triene should be stored in a cool, dry place away from direct sunlight and heat sources. It is advisable to store it in a tightly sealed container to prevent degradation. Maintain a temperature below 25°C and avoid exposure to humidity to ensure its stability.

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