(8R,9S,10R,13S,14S)-13-Ethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione | CAS No. 21800-83-9

(8R,9S,10R,13S,14S)-13-Ethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione

Basic Information

CAS Number

21800-83-9

Molecular Formula

C19H26O2

Molecular Weight

245.19 g/mol

AD

Basic Physical Properties

Melting Point

172.0 to 176.0 deg-C

Boiling Point

445.2 °C at 760 mmHg

Density

1.11

Flash Point

166 °C

Refractive Index

1.55

CCC12CCC3C(C1CCC2=O)CCC4=CC(=O)CCC34

InChI

InChI=1S/C19H26O2/c1-2-19-10-9-15-14-6-4-13(20)11-12(14)3-5-16(15)17(19)7-8-18(19)21/h11,14-17H,2-10H2,1H3/t14-,15+,16+,17-,19-/m0/s1

InChIKey

SBLHOJQRZNGHLQ-ATIFRJIPSA-N

LogP

-3.4569

Topological Polar Surface Area

137.67 Ų

Hydrogen Bond Donor/Acceptor

4 / 9

Complexity

518

Synonyms & References

English

  • 13-ethyl-gon-4-en-3,17-dione
  • (8R,9S,10R,13S,14S)-13-Ethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione
  • 13-Egedo
  • (8R, 9S, 10R, 13S, 14S)-13-ethyl-1, 2, 6, 7, 8, 9, 10, 11, 12, 14, 15, 16-dodecahydrocyclopenta[a]phenanthrene-3, 17-dione
  • 21800-83-9
  • LEVONORGESTREL IMPURITY [EP IMPURITY]
  • DTXSID801020560
  • SCHEMBL1422567
  • 18a-Homo-19-norandrost-4-ene-3,17-dione
  • DL-Ethylgonedione
  • 23477-67-0
  • D-Ethylgonendione
  • 18-Methyl-19-norandrost-4-ene-3,17-dione
  • 18-Methyl-estr-4-ene-3,17-dione
  • D-Ethyl gonendione
  • (3aS,3bR,9aR,9bS,11aS)-11a-ethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-dione
  • 18-Methylestr-4-en-3,17-dione
  • 13beta-Ethylgon-4-ene-3,17-dione
  • 13beta-ethylgon-4-en-3,17-dione
  • UNII-IH07J8F03F
  • 13beta-ethyl-gon-4-en-3,17-dione
  • EC 606-833-1
  • 13-Ethylgon-4-ene-3,17-dione (Levodione; 18-Methyl-19-norandrost-4-ene-3,17-dione)
  • 13-Ethyl-gon-4-ene-3,17-dione
  • Ethylgonendione
  • MFCD08457890
  • IH07J8F03F
  • LEVODIONE [EP IMPURITY]
  • (8R,9S,10R,13S,14S)-13-ethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione
  • Levonorgestrel Impurity L (18-Methylester-4-ene-3,17-dione)
  • Gon-4-ene-3,17-dione, 13-ethyl-, (+/-)-

MDL Number

MFCD00006472

FAQ

What are the physical and chemical properties of (8R,9S,10R,13S,14S)-13-Ethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione (CAS: 21800-83-9)?

The compound has a crystalline form and a molecular weight of approximately 422.5 g/mol. It is only slightly soluble in organic solvents such as acetone and chloroform. Chemically, it is relatively stable and does not react readily with common reagents. It is a solid at room temperature with a melting point around 150°C.

How is (8R,9S,10R,13S,14S)-13-Ethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione (CAS: 21800-83-9) typically synthesized?

This compound is typically synthesized through multistep organic reactions, involving condensation, alkylation, and cyclization steps. Commonly, a Grignard reagent is used to introduce the ethyl group. The synthesis involves the use of a solvent such as THF, and the reaction is carried out under anhydrous conditions to ensure high yield and selectivity.

What industries use (8R,9S,10R,13S,14S)-13-Ethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione (CAS: 21800-83-9)?

This compound finds applications in pharmaceuticals, where it serves as a precursor for drug synthesis. It also has potential use in the polymer industry for the development of new materials. Additionally, it may be used in sensor technology and as a raw material in semiconductor manufacturing.

What precautions should be taken when handling (8R,9S,10R,13S,14S)-13-Ethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17(2H,6H)-dione (CAS: 21800-83-9)?

When handling this compound, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. It should be stored in a well-ventilated area, preferably in a fume hood. Spills should be handled with care, and proper cleanup procedures should be followed. It is advisable to always refer to the safety data sheet (SDS) for the most up-to-date safety information.

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