Basic information
- CAS
1181-32-4- Standard SMILES
CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3C[C@H](Cl)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]12C- InChIKey
QKCQMVXAOYYSJU-IUGZLZTKSA-N- Molecular formula
- C26H32ClFO7
- Average molar mass
- 511 g/mol
Names & identifiers
- Preferred name
- 21-Acetyl-6alpha-chlorotriamcinolone Acetonide
- IUPAC
- [2-[(1S,2S,4R,8S,9S,11S,12R,13S,19S)-19-chloro-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
- English name
- 21-Acetyl-6α-chlorotriamcinolone Acetonide
- Molecular formula
- C26H32ClFO7
- Molecular weight
- 510.98
Names & synonyms
1181-32-421-Acetyl-6alpha-chlorotriamcinolone AcetonideFluocinolone Acetonide Impurity 1521-Acetyl-6alpha-chlorotriamcinoloneAcetonide(6a,11ss,16a)-21-(Acetyloxy)-6-chloro-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione; 6a-Chloro-9-fluoro-11ss,16a,17,21-tetrahydroxypregna-1,4-diene-3,20-dione 21-Acetate Cyclic 16,17-Acetal with Acetone2-((2S,6aS,6bR,7S,8aS,8bS,11aR,12aS,12bS)-2-chloro-6b-fluoro-7-hydroxy-6a,8a,10,10-tetramethyl-4-oxo-2,4,6a,6b,7,8,8a,8b,11a,12,12a,12b-dodecahydro-1H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-8b-yl)-2-oxoethyl acetateFluocinone acetate 10Fluocinolone Acetonide Impurity 2Triamcinolone Acetonide Impurity 15Triamcinolone Acetonide EP Impurity 621-Acetyl-6α-chlorotriamcinolone Acetonide21-Acetyl-6a-chlorotriamcinolone Acetonide
Show more names
6-alpha-Chloro-Triamcinolone Acetonide AcetatePregna-1,4-diene-3,20-dione, 21-(acetyloxy)-6-chloro-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-, (6α,11β,16α)-
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 99.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 1,070
Physicochemical properties
- Boiling point
- 620 · 620.0±55.0 °C(Predicted)
- Density
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- pka
- 12.81 · 12.81±0.70(Predicted)
Chemistry & industry
Applications
Uses21-Acetyl-6α-chlorotriamcinolone Acetonide is an impurity of Fluocinolone Acetonide (F455800); a glucocorticoid and anti-inflammatory agent.
Suppliers8 total
广州佳途科技股份有限公司81960175 18933936954 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
深圳市简一生物科技有限公司0755-84826604 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
深圳卓越生物医药科技有限公司0755-26050679 18318671572 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
梯尔希（南京）药物研发有限公司18012923235 18012923235 · [email protected]
Related reactions
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Compound notes
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