(6alpha,11beta,16beta)-21-Chloro-6,9-difluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl propionate

Basic Information

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CAS Number

66852-54-8

Molecular Formula

C25H31ClF2O5

Molecular Weight

484.97 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

Fine Chemicals Specialty Chemicals UV Stabilizers

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Melting Point

221°C

Boiling Point

570.691°C at 760 mmHg

SMILES

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CCC(=O)OC1(C(CC2C1(CC(C3(C2CC(C4=CC(=O)C=CC43C)F)F)O)C)C)C(=O)CCl

InChI

InChI=1S/C25H31ClF2O5/c1-5-21(32)33-25(20(31)12-26)13(2)8-15-16-10-18(27)17-9-14(29)6-7-22(17,3)24(16,28)19(30)11-23(15,25)4/h6-7,9,13,15-16,18-19,30H,5,8,10-12H2,1-4H3/t13-,15-,16-,18-,19-,22-,23-,24-,25-/m0/s1

InChIKey

BDSYKGHYMJNPAB-LICBFIPMSA-N

LogP

4.0511000000000035

Topological Polar Surface Area

80.67000000000002 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

964

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

Synonyms & References

English

PREGNA-1,4-DIENE-3,20-DIONE, 21-CHLORO-6,9-DIFLUORO-11-HYDROXY-16-METHYL-17-(1-OXOPROPOXY)-, (6.ALPHA.,11.BETA.,16.BETA.)-
Pregna-1,4-diene-3,20-dione, 21-chloro-6,9-difluoro-11-hydroxy-16-methyl-17-(1-oxopropoxy)-, (6alpha,11beta,16beta)-
Halobetasol propionate [USAN]
s4089
91A0K1TY3Z
Ultravate (TN)
HALOBETASOL PROPIONATE
HALOBETASOL PROPIONATE [USP-RS]
BMY 30056
AB01566925_01
Halobetasol propionate (USP)
Ultravate
ULOBETASOL PROPIONATE [WHO-DD]
Jemdel
ULOBETASOL PROPIONATE [MART.]
CS-4305
HALOBETASOL PROPIONATE [MI]
halobetasol-propionate
CHEMBL1200908
CHEBI:135782
Tox21_112455
Miracorten
BRYHALI
(6S,8S,9R,10S,11S,13S,14S,16S,17R)-17-(2-chloroacetyl)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl propionate
HALOBETASOL PROPIONATE [ORANGE BOOK]
D04409
SR-01000942239-1
ULOBETASOL PROPIONATE (MART.)
6 alpha-fluoroclobetasol 17-propionate
NCGC00373230-02
BMY-30056;CGP-14458;Ulobetasol propionate

MDL Number

MFCD00866013

Customs Code

2937229000

FAQ

What is (6alpha,11beta,16beta)-21-Chloro-6,9-difluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl propionate (CAS: 66852-54-8)?

This compound is a synthetic steroid derivative. It features a pregnane skeleton with specific substitutions including 21-chloro, 6,9-difluoro, 11-hydroxy, and 16-methyl groups, and a 3,20-dioxo structure. It is primarily used in research and pharmaceutical applications.

What are the main uses of (6alpha,11beta,16beta)-21-Chloro-6,9-difluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl propionate (CAS: 66852-54-8)?

This compound is mainly used in research for studying hormonal effects and in pharmaceuticals for potential therapeutic applications. It may also be used in synthetic chemistry for the development of new steroid-based drugs.

Is (6alpha,11beta,16beta)-21-Chloro-6,9-difluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl propionate (CAS: 66852-54-8) safe?

Safety depends on handling procedures. It is important to follow strict safety guidelines, including proper ventilation and the use of personal protective equipment. It is classified as a hazardous substance and should be handled with caution to prevent exposure and inhalation.

How should (6alpha,11beta,16beta)-21-Chloro-6,9-difluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl propionate (CAS: 66852-54-8) be stored?

Store in a cool, dry place away from direct sunlight and heat sources. Maintain in a tightly sealed container at temperatures below 25°C. Avoid contact with water and moisture. Handle with care to prevent spillage and ensure proper labeling and documentation.