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2-氨基喹啉-3-甲腈

更新时间:2025-09-04 20:37:40

2-氨基喹啉-3-甲腈结构式
2-氨基喹啉-3-甲腈结构式
品牌特惠专场
常用名 2-氨基喹啉-3-甲腈 英文名 3-Quinolinecarbonitrile,2-amino
CAS号 31407-25-7 分子量 169.18300
密度 1.29g/cm3 沸点 387.2ºC at 760mmHg
分子式 C10H7N3 熔点 N/A
MSDS 美版 闪点 188ºC

 2-氨基喹啉-3-甲腈名称

中文名 2-胺喹啉-3-甲腈
英文名 2-Aminoquinoline-3-carbonitrile
英文别名 更多

 2-氨基喹啉-3-甲腈物理化学性质

密度 1.29g/cm3
沸点 387.2ºC at 760mmHg
分子式 C10H7N3
分子量 169.18300
闪点 188ºC
精确质量 169.06400
PSA 62.70000
LogP 2.26988
InChIKey RANOMAHFIQOQIG-UHFFFAOYSA-N
SMILES N#Cc1cc2ccccc2nc1N
储存条件 室温
计算化学

1.疏水参数计算参考值(XlogP):2.1

2.氢键供体数量:1

3.氢键受体数量:3

4.可旋转化学键数量:0

5.互变异构体数量:2

6.拓扑分子极性表面积:62.7

7.重原子数量:13

8.表面电荷:0

9.复杂度:230

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:0

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

 2-氨基喹啉-3-甲腈安全信息

海关编码 2933499090

 2-氨基喹啉-3-甲腈合成线路

~97%

2-氨基喹啉-3-甲腈结构式

2-氨基喹啉-3-甲腈

31407-25-7

文献:Shen, Qiang; Wang, Limin; Yu, Jianjun; Liu, Mingtao; Qiu, Jun; Fang, Lei; Guo, Fenglou; Tang, Jun Synthesis, 2012 , vol. 44, # 3 art. no. H96411SS, p. 389 - 392

~90%

2-氨基喹啉-3-甲腈结构式

2-氨基喹啉-3-甲腈

31407-25-7

文献:Zhou, Long-Hu; Tu, Shu-Jiang; Shi, Da-Qin; Dai, Gui-Yuan; Chen, Wei-Xing Synthesis, 1998 , # 6 p. 851 - 854

~92%

2-氨基喹啉-3-甲腈结构式

2-氨基喹啉-3-甲腈

31407-25-7

文献:Ukhin; Belov Russian Chemical Bulletin, 2008 , vol. 57, # 2 p. 418 - 421

~%

2-氨基喹啉-3-甲腈结构式

2-氨基喹啉-3-甲腈

31407-25-7

文献:WO2012/65963 A2, ;

~%

2-氨基喹啉-3-甲腈结构式

2-氨基喹啉-3-甲腈

31407-25-7

文献:Bulletin de la Societe Chimique de France, , # 5 p. 795 - 802

 2-氨基喹啉-3-甲腈海关

海关编码 2933499090
中文概述 2933499090. 其他含喹琳或异喹啉环系的化合物〔但未进一步稠合的〕. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素 品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 2-氨基喹啉-3-甲腈靶点实验

查看更多实验

实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
实验名称:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标:N/A
External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
实验名称:Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
来源:Broad Institute
靶标:N/A
External Id:7124-01_Inhibitor_SinglePoint_HTS_Activity
实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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 2-氨基喹啉-3-甲腈英文别名

2-aminoquinoline-3-carbonitrile
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