(17beta)-17-Hydroxy(2,2,4,6,6-~2~H_5_)androst-4-en-3-one | CAS No. 21002-80-2

(17beta)-17-Hydroxy(2,2,4,6,6-~2~H_5_)androst-4-en-3-one

Basic Information

CAS Number

21002-80-2

Molecular Formula

C19H23D5O2

Molecular Weight

293.46 g/mol

AD

Basic Physical Properties

CC12CCC3C(C1CCC2O)CCC4=CC(=O)CCC34C

InChI

InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1/i3D2,7D2,11D

InChIKey

MUMGGOZAMZWBJJ-OKBZSKMBSA-N

LogP

3.8792000000000035

Topological Polar Surface Area

37.3 Ų

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

508

Synonyms & References

English

  • (1S,3aS,3bR,9aR,9bS,11aS)-1-hydroxy-9a,11a-dimethyl(5,5,6,8,8-H)-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
  • (8R,9S,10R,13S,14S,17S)-2,2,4,6,6-pentadeuterio-17-hydroxy-10,13-dimethyl-1,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
  • TESTOSTERONE-2,2,4,6,6-D5
  • Testosterone-2,2,4,6,6-d5 (1.0mg/ml in Acetonitrile)
  • 21002-80-2
  • Androst-4-en-3-one-2,2,4,6,6-d5, 17-hydroxy-, (17?)-
  • (8R, 9S, 10R, 13S, 14S, 17S)-2, 2, 4, 6, 6-pentadeuterio-17-hydroxy-10, 13-dimethyl-1, 7, 8, 9, 11, 12, 14, 15, 16, 17-decahydrocyclopenta[a]phenanthren-3-one
  • SCHEMBL1332706
  • Androst-4-en-3-one-2,2,4,6,6-d5,17-hydroxy-, (17b)-(9CI)
  • Testosterone-2,2,4,6
  • Testosterone-2,2,4,6,6-d5
  • ((2)H)5-testosterone
  • (2.2.4.6.6-D5)-Testosteron
  • [2,2,3,3-(2)H4]-succinonitrile
  • [2,2,3,3-2H4]-succinonitrile
  • [D4]succinonitrile
  • < 2,2,3,3-(2)H4> succinonitrile
  • < 2,2,3,3-2H4> succinonitrile
  • < 2,2,4,6,6-2H5> testosterone
  • < 2,3-2H4> succinonitrile
  • 293067_ALDRICH
  • d4-succinonitrile
  • I14-46195
  • Succinonitrile-d4

FAQ

What regulatory guidelines apply to (17beta)-17-Hydroxy(2,2,4,6,6-pentahydroxy-17-methyl-1,3,5-cyclohexatrien-1-yl)acetone (CAS: 21002-80-2)?

This compound is subject to the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations in the EU, and FDA/EPA guidelines for pharmaceutical and chemical industries. Regulatory requirements include proper labeling, storage, and disposal to ensure safety and compliance with environmental protection standards.

Are there alternatives to (17beta)-17-Hydroxy(2,2,4,6,6-pentahydroxy-17-methyl-1,3,5-cyclohexatrien-1-yl)acetone (CAS: 21002-80-2) in synthesis?

Synthetic alternatives may include related compounds such as androst-4-en-3-one or its isomers. Common substitutes in chemical synthesis include alternative reagents like acetyl chloride or acetic anhydride, which can serve as equivalents in certain reactions.

What is the market or research trend for (17beta)-17-Hydroxy(2,2,4,6,6-pentahydroxy-17-methyl-1,3,5-cyclohexatrien-1-yl)acetone (CAS: 21002-80-2)?

Market trends suggest increasing research interest in the compound due to its potential applications in pharmaceuticals and hormone research. Recent studies focus on its structural analogs and derivatives, with a growing emphasis on understanding its biological activities and therapeutic potential.

How should waste containing (17beta)-17-Hydroxy(2,2,4,6,6-pentahydroxy-17-methyl-1,3,5-cyclohexatrien-1-yl)acetone (CAS: 21002-80-2) be handled?

Waste containing this compound should be collected in appropriate containers, labeled with cautionary labels, and disposed of through professional waste disposal services. Incineration or chemical neutralization methods are recommended to ensure complete destruction and environmental safety. Compliance with local environmental regulations is crucial for waste management.

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