(11beta)-9-Fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate

Basic Information

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CAS Number

514-36-3

Molecular Formula

C23H31FO6

Molecular Weight

422.49 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

233-234°C

Boiling Point

575.1°C at 760 mmHg

Refractive Index

1.5980 (estimate)

Specific Rotation

D23 +123° (c = 0.64 in chloroform)

SMILES

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CC(=O)OCC(=O)C1(CCC2C1(CC(C3(C2CCC4=CC(=O)CCC43C)F)O)C)O

InChI

InChI=1S/C23H31FO6/c1-13(25)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(26)6-8-20(14,2)23(17,24)18(27)11-21(16,22)3/h10,16-18,27,29H,4-9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1

InChIKey

SYWHXTATXSMDSB-GSLJADNHSA-N

LogP

2.4445000000000006

Topological Polar Surface Area

100.9 Å²

Hydrogen Bond Donor/Acceptor

2 / 6

Complexity

838

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Synonyms & References

English

FLUDROCORTISONE ACETATE [MART.]
NSC15186
AC-18903
fludrocortisonacetat
MLS002638417
FLUDROCORTISONE ACETATE [USP-RS]
Fludrocortisone acetate, United States Pharmacopeia (USP) Reference Standard
Pregn-4-ene-3,20-dione, 21-(acetyloxy)-9-fluoro-11,17-dihydroxy-, (11.beta.)-
9-Fluorohydrocortisone acetate
FLUDROCORTISONE 21-ACETATE [MI]
Pregn-4-ene-3,20-dione, 21-(acetyloxy)-9-fluoro-11,17-dihydroxy-,(11b)-
DS-3879
HY-B1203AR
Fludrocortisoni acetas
Fludrocortisone acetate, >=98%
Florinef acetate (TN)
(11beta)-9-fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate
9alpha-Fluoro-11beta,17alpha,21-trihydroxy-4-pregnene-3,20-dione acetate
Fluohydrocortisone acetate
D00986
Q27106657
9.alpha.-Fluorohydrocortisone 21-acetate
2-((8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate
Q-201121
Cortisol, 9-fluoro-, 21-acetate
DTXSID2023062
9.alpha.-Fluorohydrocortisone-21-acetate
Fludrocortisone acetate (USP:JAN)
FLUDROCORTISONE ACETATE [ORANGE BOOK]
Florinef acetate
514-36-3 (acetate)

MDL Number

MFCD00864160

Customs Code

2937229000

FAQ

What is (11beta)-9-Fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate (CAS: 514-36-3)?

(11beta)-9-Fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate (CAS: 514-36-3) is a synthetic steroid derivative. It has a complex molecular structure and is used primarily in pharmaceutical research and development. Its chemical formula is C25H28FO5.

What are the main uses of (11beta)-9-Fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate (CAS: 514-36-3)?

This compound is mainly used in pharmaceutical research and development, particularly in the study of hormonal effects and as a potential drug candidate. It is also utilized in biochemical research to investigate the properties and functions of steroid hormones.

Is (11beta)-9-Fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate (CAS: 514-36-3) safe?

The safety of (11beta)-9-Fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate (CAS: 514-36-3) depends on the context of use. It is not intended for direct use in humans and should be handled with appropriate precautions. Exposure can lead to respiratory irritation and other health risks. It is important to follow all safety guidelines and use personal protective equipment when handling this compound.

How should (11beta)-9-Fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate (CAS: 514-36-3) be stored?

(11beta)-9-Fluoro-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl acetate (CAS: 514-36-3) should be stored in a cool, dry place away from direct sunlight and heat sources. The container should be tightly sealed to prevent moisture absorption. It is advisable to keep it in a locked storage area and follow all local regulations for the storage of hazardous chemicals. Do not store near incompatible substances such as strong acids or bases.