3 Cyclopentyl-3-(4-(7-((2-(trimethylsilyl)ethoxy)methyl)-7H-pyrrolo[2.3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)propanenitrile

HCID 57477597

基本情報

CAS
941685-39-8
標準SMILES
C[Si](C)(C)CCOCn1ccc2c(-c3cnn(C(CC#N)C4CCCC4)c3)ncnc21
InChIKey
QHQSWYIJDFMBNE-UHFFFAOYSA-N
分子式
C23H32N6OSi
平均分子量
436.6 g/mol

名称と識別子

優先名称
3 Cyclopentyl-3-(4-(7-((2-(trimethylsilyl)ethoxy)methyl)-7H-pyrrolo[2.3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)propanenitrile
IUPAC
3-cyclopentyl-3-[4-[7-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-d]pyrimidin-4-yl]pyrazol-1-yl]propanenitrile
英語名
1H-Pyrazole-1-propanenitrile, β-cyclopentyl-4-[7-[[2-(triMethylsilyl)ethoxy]Methyl]-7H-pyrrolo[2,3-d]pyriMidin-4-yl]-
分子式
C23H32N6OSi
分子量
436.63

名称と別名

941685-39-83 Cyclopentyl-3-(4-(7-((2-(trimethylsilyl)ethoxy)methyl)-7H-pyrrolo(2.3-d)pyrimidin-4-yl)-1H-pyrazol-1-yl)propanenitrile3 Cyclopentyl-3-(4-(7-((2-(trimethylsilyl)ethoxy)methyl)-7H-pyrrolo[2.3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)propanenitrileRefChem:484487692-040-63-cyclopentyl-3-(4-(7-((2-(trimethylsilyl)ethoxy)methyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)propanenitrile1H-Pyrazole-1-propanenitrile, beta-cyclopentyl-4-[7-[[2-(triMethylsilyl)ethoxy]Methyl]-7H-pyrrolo[2,3-d]pyriMidin-4-yl]-1H-Pyrazole-1-propanenitrile, |A-cyclopentyl-4-[7-[[2-(triMethylsilyl)ethoxy]Methyl]-7H-pyrrolo[2,3-d]pyriMidin-4-yl]-3-Cyclopentyl-3-[4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1H-pyrazol-1-yl]propanenitrile(betaR)-beta-Cyclopentyl-4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1H-pyrazole-1-propanenitrile1H-Pyrazole-1-propanenitrile, beta-cyclopentyl-4-[7-[[2-(triMethylsilyl)ethoxy]Methyl]-7H-pyrrolo[2,3-d]pyriMidin-4-yl]-, (betaR)-Ruxolitinib Acrylo pyrimidine Impurity
名称をさらに表示
Ruxolitinib 2-(trimethylsilyl)ethoxy)methyl Impurity1-((2-(Trimethylisilyl)ethoxy)methyl)-1H-pyrazole derivative3-Cyclopentyl-3-[4-[7-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-d]pyrimidin-4-yl]pyrazol-1-yl]propanenitrilecyclopentyl-3-[4-(7-[2-(trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrile1H-Pyrazole-1-propanenitrile, β-cyclopentyl-4-[7-[[2-(triMethylsilyl)ethoxy]Methyl]-7H-pyrrolo[2,3-d]pyriMidin-4-yl]-3-cyclopentyl-3-[4-(7-[2-(trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrileRuxolitinib Acrylo pyrimidine ImpurityQ: What is Ruxolitinib Acrylo pyrimidine Impurity Q: What is the CAS Number of Ruxolitinib Acrylo pyrimidine Impurity Q: What is the storage condition of Ruxolitinib Acrylo pyrimidine Impurity
Ruxolitinib Impurity N629ZNS6XXG5SCHEMBL100448SCHEMBL13243688WLZ3845QHQSWYIJDFMBNE-UHFFFAOYSA-NCS-M2190MFCD26960983

データベース識別子

CAS
941685-39-8
PubChem CID
57477597
UNII
29ZNS6XXG5
EC Number
692-040-6

物性

構造計算による物性

極性表面積
81.6 Ų
水素結合供与体数
0
水素結合受容体数
5
回転可能結合数
9
重原子数
31

物理化学的性質

沸点
609.8 · 609.8±55.0 °C(Predicted)
比重(密度)
1.19 · 1.19±0.1 g/cm3(Predicted)
酸解離定数(Pka)
3.66 · 3.66±0.30(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P203, P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P316, P303+P361+P353, P318, P321, P330, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

安全データ

危険有害性情報
コード 危険有害性情報 危険有害性クラス 区分 注意喚起語 シンボル P コード H225

化学と産業

サプライヤー37 社

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
咸宁深蓝生物医药研发有限公司18171815831 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
武汉华瀚鼎诚新材料科技有限公司027-81388558 18963961905 · [email protected]

関連反応

24 件

化合物ノート

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