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5-(2-噻吩基)-2H-四唑

更新时间:2025-08-25 20:13:21

5-(2-噻吩基)-2H-四唑结构式
5-(2-噻吩基)-2H-四唑结构式
品牌特惠专场
常用名 5-(2-噻吩基)-2H-四唑 英文名 2H-Tetrazole,5-(2-thienyl)
CAS号 59541-58-1 分子量 152.17700
密度 1.489g/cm3 沸点 357.163ºC at 760 mmHg
分子式 C5H4N4S 熔点 N/A
MSDS N/A 闪点 178.327ºC

 5-(2-噻吩基)-2H-四唑名称

中文名 5-(2-噻吩基)-2H-四唑
英文名 5-thiophen-2-yl-2H-tetrazole
中文别名 5-(2-噻吩基)-1H-四唑
英文别名 更多

 5-(2-噻吩基)-2H-四唑物理化学性质

密度 1.489g/cm3
沸点 357.163ºC at 760 mmHg
分子式 C5H4N4S
分子量 152.17700
闪点 178.327ºC
精确质量 152.01600
PSA 82.70000
LogP 0.92820
InChIKey XVVLITRCMAVPPY-UHFFFAOYSA-N
SMILES c1csc(-c2nn[nH]n2)c1
折射率 1.665
储存条件 室温
计算化学

1.疏水参数计算参考值(XlogP):0.9

2.氢键供体数量:1

3.氢键受体数量:4

4.可旋转化学键数量:1

5.互变异构体数量:2

6.拓扑分子极性表面积:82.7

7.重原子数量:10

8.表面电荷:0

9.复杂度:120

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

 5-(2-噻吩基)-2H-四唑安全信息

危害码 (欧洲) Xi
海关编码 2934999090

 5-(2-噻吩基)-2H-四唑合成线路

~99%

5-(2-噻吩基)-2H-四唑结构式

5-(2-噻吩基)-2H-四唑

59541-58-1

文献:Akhlaghinia, Batool; Rezazadeh, Soodabeh Journal of the Brazilian Chemical Society, 2012 , vol. 23, # 12 p. 2197 - 2203

~72%

5-(2-噻吩基)-2H-四唑结构式

5-(2-噻吩基)-2H-四唑

59541-58-1

文献:Akula, Ravi Kumar; Adimulam, Chandra S.; Gangaram, Sathaiah; Kengiri, Raju; Banda, Narsaiah; Pamulaparthy, Shanthan R. Letters in Organic Chemistry, 2014 , vol. 11, # 6 p. 440 - 445

~83%

5-(2-噻吩基)-2H-四唑结构式

5-(2-噻吩基)-2H-四唑

59541-58-1

文献:Sridhar, Madabhushi; Mallu, Kishore Kumar Reddy; Jillella, Raveendra; Godala, Kondalreddy; Beeram, Chinaramanaiah; Chinthala, Narsaiah Synthesis (Germany), 2013 , vol. 45, # 4 art. no. SS-2012-Z0887-OP, p. 507 - 510

~%

5-(2-噻吩基)-2H-四唑结构式

5-(2-噻吩基)-2H-四唑

59541-58-1

文献:Journal of the American Chemical Society, , vol. 72, p. 3379,3380

 5-(2-噻吩基)-2H-四唑上下游产品

5-(2-噻吩基)-2H-四唑上游产品  4

5-(2-噻吩基)-2H-四唑下游产品  1

 5-(2-噻吩基)-2H-四唑海关

海关编码 2934999090
中文概述 2934999090. 其他杂环化合物. 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
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 5-(2-噻吩基)-2H-四唑靶点实验

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:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
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: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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 5-(2-噻吩基)-2H-四唑英文别名

5-thien-2-yl-2h-tetraazole
5-thien-2-yl-2H-tetrazole
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