(17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one

Basic Information

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CAS Number

571-92-6

Molecular Formula

C18H22O3

Molecular Weight

286.37 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

281-283 °C

Boiling Point

478.9°Cat760mmHg

Density

1.249

Flash Point

257.5°C

Refractive Index

1.611

SMILES

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CC12CCC3C(C1CCC2O)CC(=O)C4=C3C=CC(=C4)O

InChI

InChI=1S/C18H22O3/c1-18-7-6-12-11-3-2-10(19)8-14(11)16(20)9-13(12)15(18)4-5-17(18)21/h2-3,8,12-13,15,17,19,21H,4-7,9H2,1H3/t12-,13-,15+,17+,18+/m1/s1

InChIKey

ZHTDDOWJIRXOMA-YVEZLPLXSA-N

LogP

3.2494000000000014

Topological Polar Surface Area

57.53 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

448

Synonyms & References

English

6-Ketoestradiol; Estradiol Related Compound C
Opera_ID_400
AC-32558
Estra-1,3,5(10)-trien-6-one, 3,17-dihydroxy-, (17.beta.)-
ZHTDDOWJIRXOMA-YVEZLPLXSA-N
BCP28466
(17.BETA.)-3,17-DIHYDROXYESTRA-1,3,5(10)-TRIEN-6-ONE
3,17beta-Dihydroxy-1,3,5(10)-estratrien-6-one
571-92-6
MFCD00056457
UNII-BZ2CJW3GSE
beta-Estradiol-6-one
NSC 147966
6-Keto 17Beta-Estradiol
MLS001076506
6-Keto 17
6-Ketoestradiol
Estra-1,3,5(10)-trien-6-one, 3,17-dihydroxy-, (17b)-
Estra-1,3,5(10)-trien-6-one, 3,17-dihydroxy-, (17beta)-
MLS000069457
beta -Estradiol-6-one
A-Estradiol
(8R,9S,13S,14S,17S)-3,17-dihydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-one
SMR000059005
SCHEMBL2542940
HMS2235M03
BZ2CJW3GSE
CS-W010017
HY-W009301
(8R,9S,13S,14S,17S)-13-methyl-3,17-bis(oxidanyl)-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-one
6-Keto 17b-Estradiol

MDL Number

MFCD00056457

FAQ

What regulatory guidelines apply to (17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one (CAS: 571-92-6)?

The compound (17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one (CAS: 571-92-6) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which includes classifications for health hazards, environmental hazards, and flammability. Additionally, it falls under the European Union's REACH regulations and may be subject to FDA and EPA regulations in the United States, particularly concerning its use in medical and pharmaceutical applications.

Are there alternatives to (17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one (CAS: 571-92-6) in synthesis?

Alternatives to (17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one (CAS: 571-92-6) include other steroid hormones and their derivatives, such as dihydrotestosterone or estradiol, which can be used as synthetic equivalents. Common alternative reagents include androstenedione and dehydroepiandrosterone (DHEA) in the synthesis of related compounds.

What is the market or research trend for (17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one (CAS: 571-92-6)?

The market for (17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one (CAS: 571-92-6) is driven by its use in research and development for hormone replacement therapy and anti-aging treatments. Research trends focus on understanding its bioavailability, metabolism, and potential therapeutic applications in reproductive health and sports medicine. The market is expected to grow as more studies validate its efficacy and safety.

How should waste containing (17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one (CAS: 571-92-6) be handled?

Waste containing (17beta)-3,17-Dihydroxyestra-1,3,5(10)-trien-6-one (CAS: 571-92-6) should be collected in appropriate containers and disposed of through professional waste handling services. Incineration is a common method, but it must be conducted in an enclosed and properly regulated system to minimize environmental impact. Environmental protection measures include ensuring the waste is fully neutralized and the incineration process is monitored to comply with local and international environmental regulations.