15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione | CAS No. 60919-46-2

15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione

Basic Information

CAS Number

60919-46-2

Molecular Formula

C20H28O3

Molecular Weight

316.44 g/mol

AD

Basic Physical Properties

Boiling Point

489.8±45.0 °C(Predicted)

Density

1.19±0.1 g/cm3(Predicted)

C[C@@]1(CCC(C=C1CC[C@@]2([H])[C@]3([H])[C@@H](O)C4)=O)[C@@]2([H])CC[C@]3(CC)C4=O

InChI

InChI=1S/C20H28O3/c1-3-20-9-7-15-14(18(20)16(22)11-17(20)23)5-4-12-10-13(21)6-8-19(12,15)2/h10,14-16,18,22H,3-9,11H2,1-2H3/t14-,15+,16+,18-,19+,20-/m1/s1

InChIKey

RRKZQLKPNQKXFJ-JSQCUCEHSA-N

LogP

3.4483000000000024

pKa

13.89±0.40(Predicted)

Topological Polar Surface Area

54.37 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Synonyms & References

English

  • Gon-4-ene-3,17-dione,13-ethyl-15-hydroxy-, (15a)-
  • 13BETA-ETHYL-15A-HYDROXY-18-NORANDROST-4-ENE-3,17-DIONE
  • 15ALPHA-HYDROXY-18-METHYL-ESTRA-4-ENE-3,17-DIONE
  • 15α-Hydroxy-13β-ethyl-4-gonene-3,17-dione
  • 13BETA-ETHYL-15ALPHA-HYDROXY-18-NORANDROST-4-ENE-3,17-DIONE
  • Gestodene InterMediates
  • (8R,9S,10R,13S,14S,15S)-13-ethyl-15-hydroxy-1,6,7,8,9,10,11,12,13,
  • 15α-hydroxy-18-methyl-estra-4-ene-3,17-dione
  • 15α-hydroxy-18-Methyl-estr-4-ene-3,17-dione
  • (8R,9S,10R,13S,14S,15S)-13-Ethyl-15-hydroxy-10-methyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione
  • 15alpha-hydroxy-18-methyl-estra-4-ene-3,18-dione
  • 15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione

MDL Number

MFCD08703306

FAQ

What are the physical and chemical properties of 15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione (CAS: 60919-46-2)?

15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione (CAS: 60919-46-2) is a solid at room temperature with a molecular weight of approximately 284.41 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and chloroform. The compound is relatively stable under normal conditions but can undergo hydrolysis under acidic or basic conditions. It is not reactive towards typical electrophiles or nucleophiles under standard reaction conditions.

How is 15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione (CAS: 60919-46-2) typically synthesized?

15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione (CAS: 60919-46-2) is typically synthesized via a multi-step process involving the introduction of a methyl group, followed by hydroxylation and ethylation. The reaction is catalyzed by metal complexes and requires precise control of reaction conditions to achieve high selectivity and yield. Detailed procedures are often found in specialized chemical literature and patents.

What industries use 15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione (CAS: 60919-46-2)?

15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione (CAS: 60919-46-2) is primarily used in the pharmaceutical industry for the synthesis of certain drug compounds. It is also utilized in research and development for its unique structural features, which may have applications in pharmacology, polymer chemistry, and material science.

What precautions should be taken when handling 15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione (CAS: 60919-46-2)?

When handling 15a-Hydroxy-13b-ethyl-4-gonene-3,17-dione (CAS: 60919-46-2), it is important to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. The compound should be stored in a cool, dry place away from direct sunlight. In case of accidental spill, it should be handled with a fume hood to minimize exposure and according to the Material Safety Data Sheet (MSDS) guidelines. For detailed safety information, refer to the latest SDS provided by the supplier.

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