1-[(8S,13S,14S,17R)-17-Hydroxy-13-methyl-1,2,4,6,7,8,12,13,14,15,16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolan]-17-yl]ethanone | CAS No. 42982-49-0

1-[(8S,13S,14S,17R)-17-Hydroxy-13-methyl-1,2,4,6,7,8,12,13,14,15,16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolan]-17-yl]ethanone

Basic Information

CAS Number

42982-49-0

Molecular Formula

C22H30O4

Molecular Weight

358.48 g/mol

AD

Basic Physical Properties

CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC=C3[C@H]2CCC4=C3CCC5(C4)OCCO5)C)O

InChI

InChI=1S/C22H30O4/c1-14(23)22(24)10-7-19-18-4-3-15-13-21(25-11-12-26-21)9-6-16(15)17(18)5-8-20(19,22)2/h5,18-19,24H,3-4,6-13H2,1-2H3/t18-,19+,20+,22+/m1/s1

InChIKey

GJXAERIRKRLZJY-AQCRLBJHSA-N

LogP

3.6865000000000028

Topological Polar Surface Area

55.760000000000005 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Synonyms & References

English

  • 19-Norpregna-5(10),9(11)-diene-3,20-dione,17-hydroxy-, cyclic 3-(1,2-ethanediyl acetal)
  • 1-[(8S,13S,14S,17R)-17-hydroxy-13-methyl-spiro[1,2,4,6,7,8,12,14, 15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-y l]ethanone
  • 3-(Ethylcarbamoyl)benzeneboronic acid
  • 3-(ethylcarbamoyl)phenylboronic acid
  • 3-(N-Ethylaminocarbonyl)benzeneboronic acid
  • 3-(N-Ethylaminocarbonyl)phenylboronic acid
  • AC1MTSFI
  • ACMC-209q0a
  • CTK5F3910
  • SureCN3031782
  • 1-((8S,13S,14S,17R)-17-hydroxy-13-methyl-1,2,4,6,7,8,12,13,14,15
  • 16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolan]-17-yl)ethan-1-one

FAQ

What are the physical and chemical properties of 1-[(8S,13S,14S,17R)-17-Hydroxy-13-methyl-1,2,4,6,7,8,12,13,14,15,16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolan]-17-yl]ethanone (CAS: 42982-49-0)?

This compound has a crystalline form at room temperature with a molecular weight of approximately 630.73 g/mol. It is slightly soluble in common organic solvents like methanol and acetone but is practically insoluble in water. The compound is moderately reactive, particularly toward nucleophiles and bases. It can react with alcohols and amines under mild conditions, and it is prone to hydrolysis under acidic or basic conditions.

How is 1-[(8S,13S,14S,17R)-17-Hydroxy-13-methyl-1,2,4,6,7,8,12,13,14,15,16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolan]-17-yl]ethanone (CAS: 42982-49-0) typically synthesized?

This compound can be synthesized via multistep organic synthesis involving reactions such as alkylation, hydroxylation, and spirocyclization. Commonly, this involves the use of transition metal catalysts like palladium or platinum for key steps. The yield and selectivity can be optimized by adjusting reaction conditions and using protecting groups.

What industries use 1-[(8S,13S,14S,17R)-17-Hydroxy-13-methyl-1,2,4,6,7,8,12,13,14,15,16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolan]-17-yl]ethanone (CAS: 42982-49-0)?

This compound is used in the pharmaceutical industry for its potential therapeutic applications. It may also find applications in polymer chemistry for developing new materials with specific properties and in the production of sensors for detecting specific chemical analytes.

What precautions should be taken when handling 1-[(8S,13S,14S,17R)-17-Hydroxy-13-methyl-1,2,4,6,7,8,12,13,14,15,16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolan]-17-yl]ethanone (CAS: 42982-49-0)?

When handling this compound, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. Ensure the use of a fume hood during handling and synthesis. Spills should be carefully cleaned up with appropriate absorbent materials, and proper disposal methods should be followed. Always consult the Safety Data Sheet (SDS) for detailed handling and disposal instructions.

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