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2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate | CAS No. 3870-07-3

2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate

Basic Information

Chemical_Structure_Of
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CAS Number

3870-07-3

Molecular Formula

C26H33FO7

Molecular Weight

476.54 g/mol

AD

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
Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds
Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates
Fine Chemicals Surfactants Anionic Surfactants
Fine Chemicals Specialty Chemicals UV Stabilizers
Polymers and Plastics Thermoplastics Polyolefins
Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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CC(=O)OCC(=O)C12C(CC3C1(CC(C4(C3CCC5=CC(=O)C=CC54C)F)O)C)OC(O2)(C)C

InChI

InChI=1S/C26H33FO7/c1-14(28)32-13-20(31)26-21(33-22(2,3)34-26)11-18-17-7-6-15-10-16(29)8-9-23(15,4)25(17,27)19(30)12-24(18,26)5/h8-10,17-19,21,30H,6-7,11-13H2,1-5H3

InChIKey

VOBDXTSTTMAKHK-UHFFFAOYSA-N

LogP

2.989600000000001

Topological Polar Surface Area

99.13000000000001 Ų

Hydrogen Bond Donor/Acceptor

1 / 7

Complexity

1030

Synonyms & References

English

  • TRIAMCINOLONE ACETONIDE ACETATE [WHO-DD]
  • 9-Fluoro-11beta-hydroxy-16alpha,17-(1-methylethylidenedioxy)-3,20-dioxopregna-1,4-dien-21-yl Acetate (21-Acetate Triamcinolone Acetonide)
  • 576QLL2I1Z
  • PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXY-, CYCLIC 16,17-ACETAL WITH ACETONE, 21-ACETATE
  • EINECS 223-388-5
  • Q27261478
  • TRIAMCINOLONE ACETONIDE 21-ACETATE [MI]
  • (11beta,16alpha)-21-(Acetyloxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-pregna-1,4-diene-3,20-dione
  • SCHEMBL11422147
  • 2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo- 2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-7,9-dioxa- pentaleno[2,1-a]phenanthren-6b-yl)-2-oxoethyl acetate
  • AC-8113
  • TRIAMCINOLONE ACETONIDE IMPURITY F [EP IMPURITY]
  • 9-Fluoro-11beta,21-dihydroxy-16alpha,17-(isopropylidenedioxy)pregna-1,4-diene-3,20-dione 21-acetate
  • Triamcinolone acetonide acetate
  • 2-((6AS,6bR,7S,8aS,8bS,11aR,12aS,12bS)-6b-fluoro-7-hydroxy-6a,8a,10,10-tetramethyl-4-oxo-1,2,4,6a,6b,7,8,8a,11a,12,12a,12b-dodecahydro-8bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-8b-yl)-2-oxoethyl acetate
  • DTXSID20959526
  • 3870-07-3
  • 21-(Acetyloxy) Triamcinolone Acetonide
  • [2-[(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] acetate
  • UNII-576QLL2I1Z
  • TRIAMCINOLONE ACETONIDE 21-ACETATE
  • AKOS015962822
  • Triamcinolone acetonide 21-acetate 100 microg/mL in Acetonitrile
  • PREGNA-1,4-DIENE-3,20-DIONE, 21-(ACETYLOXY)-9-FLUORO-11-HYDROXY-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (11.BETA.,16.ALPHA.)-
  • CS-0452021
  • 9-fluoro-11β,21-dihydroxy-16α,17-(isopropylidenedioxy)pregna-1,4-diene-3,20-dione 21-acetate
  • 9-fluoro-11beta,21-dihydroxy-16alpha,17-(isopropylidenedioxy)pregna-1,4-diene-3,20-dione 21-acetate
  • 9-Fluoro-11b,21-dihydroxy-16a,17-(isopropylidenedioxy)pregna-1,4-diene-3,20-dione 21-acetate
  • 21-(Acetyloxy)-9-fluoro-11β-hydroxy-16α,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione
  • Triamcinolone aceton
  • 21-(Acetyloxy) TriaMcinolone Acetonide

MDL Number

MFCD09954497

FAQ

What is 2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate (CAS: 3870-07-3)?
This compound, identified by CAS number 3870-07-3, is a complex organic molecule with a fluoro, hydroxy, and multiple methyl groups attached to a fused ring system. It contains a dioxol ring and is classified as a synthetic organic compound, often used in specialized chemical applications. Its molecular structure includes functional groups such as ester and ketone, contributing to its chemical reactivity and stability.

What are the main uses of 2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate (CAS: 3870-07-3)?
The compound is primarily used in pharmaceutical research as a potential synthetic intermediate for drug development. It may also find applications in organic synthesis, specialty chemical manufacturing, and as a research tool for studying molecular interactions. Due to its complex structure, it is less commonly used in industrial or consumer products.

Is 2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate (CAS: 3870-07-3) safe?
Safety data for this compound is limited, but as with many organic chemicals, it requires careful handling. Precautions include wearing protective gloves, goggles, and clothing, and ensuring proper ventilation. It should be stored in a controlled environment to prevent exposure. Always follow safety guidelines from regulatory bodies like OSHA or EPA when working with this substance.

How should 2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate (CAS: 3870-07-3) be stored?
This compound should be stored in a tightly sealed container in a cool, dry place, away from light and moisture. Maintain storage temperature below 25°C and ensure humidity levels are controlled. Avoid exposure to air and store in a well-ventilated area to preserve stability and prevent degradation.

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2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate — Shanghai Titan Shareholding Technology Co., Ltd.

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2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate — Shandong Ta Hua Biotechnology Co., Ltd.

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2-(4b-Fluoro-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate — Shanghai Yinxin Laboratory Equipment Co., Ltd.

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