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Methyl 3-(2,6-difluorophenylsulfonamido)-2-fluorobenzoate

 структура
1195768-19-4
CAS №
1195768-19-4
английское имя:
Methyl 3-(2,6-difluorophenylsulfonamido)-2-fluorobenzoate
Синонимы:
DABRAFENIB INT;Dalafenib intermediate 3;Methyl 3-(2,6-difluorophenylsulfonaMido)-2-fluorobenzoate;Methyl 3-{[(2,6-difluoropheyl)sulfonyl]aMino}-2-fluorabenzoate;methyl 3-(((2,6-difluorophenyl)sulfonyl)amino)-2-fluorobenzo...;Methyl 3-{[(2,6-difluorophenyl)sulfonyl]aMino}-2-fluorobenzoate;Benzoic acid, 3-[[(2,6-difluorophenyl)sulfonyl]amino]-2-fluoro-, methyl ester
CBNumber:
CB92703779
Формула:
C14H10F3NO4S
молекулярный вес:
345.29
MOL File:
1195768-19-4.mol

Methyl 3-(2,6-difluorophenylsulfonamido)-2-fluorobenzoate атрибут

Температура кипения: 445.4±55.0 °C(Predicted)
плотность: 1.507±0.06 g/cm3(Predicted)
температура хранения: Sealed in dry,Room Temperature
растворимость: DMSO (Slightly), Methanol (Slightly)
пка: 6.68±0.10(Predicted)
форма: Solid
цвет: White to Off-White
InChI: InChI=1S/C14H10F3NO4S/c1-22-14(19)8-4-2-7-11(12(8)17)18-23(20,21)13-9(15)5-3-6-10(13)16/h2-7,18H,1H3
ИнЧИКей: COSCWKICERLCEK-UHFFFAOYSA-N
SMILES: C(OC)(=O)C1=CC=CC(NS(C2=C(F)C=CC=C2F)(=O)=O)=C1F

Заявления о рисках и безопасности

Methyl 3-(2,6-difluorophenylsulfonamido)-2-fluorobenzoate химические свойства, назначение, производство

Синтез

Methyl 3-amino-2-fluorobenzoate was charged to the reactor, followed by dichloromethane. The contents were stirred and cooled to ~15°C, and pyridine was added. After that, the reactor contents were adjusted to ~15°C, and adding 2,6-diflurorobenzenesulfonyl chloride was started via an addition funnel. The temperature during addition was kept at <25°C. After complete addition, the reactor contents were warmed to 20-25°C and held overnight. Ethyl acetate was added, and dichloromethane was removed by distillation. Once distillation was complete, the reaction mixture was diluted again with ethyl acetate (5 vol) and concentrated. Methyl 3-(2,6-difluorophenylsulfonamido)-2-fluorobenzoate was obtained through further purification.Methyl 3-{[(2,6-difluoropheyl)sulfonyl]aMino}-2-fluorabenzoate

хранилище

Keep container tightly closed under nitrogen or argon and refrigerate for long-term shelf life.

Methyl 3-(2,6-difluorophenylsulfonamido)-2-fluorobenzoate препаратная продукция и сырье

сырьё

препарат


Methyl 3-(2,6-difluorophenylsulfonamido)-2-fluorobenzoate поставщик

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