16-Dehydropregnenolone acetate

Basic Information

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CAS Number

979-02-2

Molecular Formula

C23H32O3

Molecular Weight

148.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Melting Point

170-178 ºC

Boiling Point

464.4°C at N/A mmHg

Density

1.11

Flash Point

200.1°C

Refractive Index

1.546

Specific Rotation

-38 ° - -45 ° (c= 0.9, CHCl3)

SMILES

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CC(=O)C1=CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C

InChI

InChI=1S/C23H32O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,17-18,20-21H,6,8-13H2,1-4H3/t17-,18-,20-,21-,22-,23+/m0/s1

InChIKey

MZWRIOUCMXPLKV-RFOVXIPZSA-N

LogP

0.03499999999999992

Topological Polar Surface Area

52.9 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

702

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

16-dehydropregnenolone acetate
16 DPA
20-oxopregna-5,16-dien-3-beta-yl acetate
4-Toluenesulfonic Acid Monohydrate
16-DPA
16-DEHYDROPREGNENOLONE ACETATE (16-DPA)
3b-Acetoxy-5,16-pregnadien-20-one
3b-Hydroxy-5,16-pregnadien-20-one acetate
5,16-Pregnadien-3b-ol-20-one acetate
16-Dehydropregenolone Acetate
DEHYDROPREGNENOLONE ACETATE, 16-(RG)
Dehydropregnenolone acetate
16,17-Didehydropregnenolone acetate
MZWRIOUCMXPLKV-RFOVXIPZSA-N
20-
5,16-Pregnadiene-3.beta.-ol-20-one acetate
(-)-16-Dehydropregnenolone Acetate
4-08-00-01125 (Beilstein Handbook Reference)
Pregna-5,16-dien-20-one, 3-beta-hydroxy-, acetate
832VMW7ZGC
Pregna-5,16-dien-20-one, 3beta-hydroxy-, acetate
3.beta.-Acetoxypregna-5,16-dien-20-one
Pregna-5, 3.beta.-hydroxy-, acetate
Pregna-5, 3-(acetyloxy)-, (3.beta.)-
NSC 37741
20-Oxopregna-5,16-dien-3beta-yl acetate
979-02-2
CHEBI:34163
NSC37741
CS-0015248
16-Dehydro pregnenolone acetate

MDL Number

MFCD00051130

FAQ

What is 16-Dehydropregnenolone acetate (CAS: 979-02-2)?

16-Dehydropregnenolone acetate is a steroidal compound with the chemical formula C22H34O3. It is a derivative of pregnenolone and is commonly used in biochemical research. This compound is known for its structural similarity to other steroid hormones and exhibits specific solubility and melting point characteristics, making it suitable for various analytical applications.

What are the main uses of 16-Dehydropregnenolone acetate (CAS: 979-02-2)?

16-Dehydropregnenolone acetate is primarily used in pharmaceutical research for studying hormone-related pathways. It also finds applications in biochemical assays and as a reference standard in analytical chemistry. Its use in the food industry is limited, but it may be employed in research related to nutritional supplements and metabolic studies.

Is 16-Dehydropregnenolone acetate (CAS: 979-02-2) safe?

16-Dehydropregnenolone acetate is generally considered safe when handled properly. However, as with any chemical, it is important to follow standard safety protocols, including the use of personal protective equipment. It is not classified as highly toxic, but long-term exposure or ingestion should be avoided. Safety data sheets should be consulted for detailed handling and disposal instructions.

How should 16-Dehydropregnenolone acetate (CAS: 979-02-2) be stored?

16-Dehydropregnenolone acetate should be stored in a cool, dry place away from direct light. It is typically kept in airtight containers at a temperature below 25°C and humidity levels below 60%. Proper storage ensures stability and prevents degradation, maintaining its chemical integrity for research and analytical purposes.