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Type HazMat fee for 500 gram (Estimated)
Excepted Quantity USD 0.00
Limited Quantity USD 15-60
Inaccessible (Haz class 6.1), Domestic USD 80+
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Chemical Structure| 4759-48-2 Chemical Structure| 4759-48-2
Chemical Structure| 4759-48-2

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Isotretinoin, an analogue of retinoic acid, is an agonist of retinoic acid receptors that is used for the treatment of severe acne.

Synonyms: 13-cis-Retinoic acid; AGN 190013; Zenatane

4.5 *For Research Use Only !

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Product Details of Isotretinoin

CAS No. :4759-48-2
Formula : C20H28O2
M.W : 300.44
SMILES Code : O=C(O)/C=C(C)\C=C\C=C(C)\C=C\C1=C(C)CCCC1(C)C
Synonyms :
13-cis-Retinoic acid; AGN 190013; Zenatane
MDL No. :MFCD00079542
InChI Key :SHGAZHPCJJPHSC-XFYACQKRSA-N
Pubchem ID :5282379

Safety of Isotretinoin

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H315-H319-H335-H360
Precautionary Statements:P201-P302+P352-P305+P351+P338-P308+P313
Class:6.1
UN#:2811
Packing Group:

Application In Synthesis of Isotretinoin

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 4759-48-2 ]

[ 4759-48-2 ] Synthesis Path-Downstream   1~4

  • 1
  • [ 472-86-6 ]
  • [ 4759-48-2 ]
  • [ 71423-68-2 ]
  • 3
  • [ 79-81-2 ]
  • [ 4759-48-2 ]
  • 4
  • [ 854601-60-8 ]
  • [ 4759-48-2 ]
  • [ 854601-61-9 ]
YieldReaction ConditionsOperation in experiment
With benzotriazol-1-ol; dicyclohexyl-carbodiimide; In benzene; at 20℃; 0.349 grams of CH3(OCH2CH2)11-NH2 (0.6789 mmoles), 0.044 grams of 1-hydroxybenzyltriazole (0.3328 mmoles), and 0.204 grams of 13-cis-retinoic acid (0.6789 mmoles) was dissolved in 10 mL of benzene. To this solution was added 0.192 g 1,3-dicyclohexylcarbodiimide (0.9318 mmoles) and the reaction mixture was stirred overnight at room temperature. The reaction mixture was filtered and the solvent distilled off using rotary evaporation. The product was dried under vacuum and dissolved in 20 mL dichloromethane. The solution was washed twice with 15 mL of deionized water and the organic phase dried over Na2SO4. The solution was filtered and the solvent was distilled off by rotary evaporation. To the recovered product was added 2 drops of dichloromethane containing 50 ppm butylated hydroxytoluene, and the product was dried under vacuum. Yield 0.541 g. 1H NMR (DMSO): δ 1.01 (s, 2 CH3), 1.68 (s, CH3), 3.5 (br m, PEG), 6.20 (m, 3H).
 

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