3-苯基-1H-吡唑-5-羧酸乙酯

• 常用名: 3-苯基-1H-吡唑-5-羧酸乙酯
• 英文名: Ethyl 3-phenyl-1H-pyrazole-5-carboxylate
• CAS号: 13599-12-7
• 分子量: 216.23600
• 密度: N/A
• 沸点: 427.9°C at 760 mmHg
• 分子式: C₁₂H₁₂N₂O₂
• 熔点: N/A
• 闪点: 212.6°C

3-苯基-1H-吡唑-5-羧酸乙酯名称

• 中文名: 3-苯基-1H-吡唑-5-羧酸乙酯
• 英文名: Ethyl 3-phenyl-1H-pyrazole-5-carboxylate

3-苯基-1H-吡唑-5-羧酸乙酯物理化学性质

• 沸点: 427.9°C at 760 mmHg
• 分子式: C₁₂H₁₂N₂O₂
• 分子量: 216.23600
• 闪点: 212.6°C
• 精确质量: 216.09000
• PSA: 54.98000
• LogP: 2.25340
• 储存条件: 室温，避光干燥密封
• 分子结构:

  1、 摩尔折射率：59.77

  2、 摩尔体积（cm³/mol）：180.6

  3、 等张比容（90.2K）：479.0

  4、 表面张力（dyne/cm）：49.4

  5、 极化率（10-24cm3）：23.69

• 计算化学:

  1.疏水参数计算参考值（XlogP）:2.4

  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:4

  5.互变异构体数量:4

  6.拓扑分子极性表面积55

  7.重原子数量:16

  8.表面电荷:0

  9.复杂度:239

  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

3-苯基-1H-吡唑-5-羧酸乙酯MSDS

3-苯基-1H-吡唑-5-羧酸乙酯MSDS英文版

3-苯基-1H-吡唑-5-羧酸乙酯安全信息

• 海关编码: 2933199090

3-苯基-1H-吡唑-5-羧酸乙酯海关

• 海关编码: 2933199090
• 中文概述: 2933199090. 其他结构上有非稠合吡唑环化合物. 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, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
• Summary: 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3-苯基-1H-吡唑-5-羧酸乙酯靶点实验

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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

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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：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

实验名称：Fluorescence polarization-based biochemical high throughput primary assay to identify... 来源：The Scripps Research Institute Molecular Screening Center 靶标：RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens] External Id：SIAE_INH_FP_1536_1X%INH PRUN

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3-苯基-1H-吡唑-5-羧酸乙酯英文别名

• 3-methyl-pyrazole
• 5-phenyl-2H-pyrazole-3-carboxylic acid ethyl ester
• MFCD03130041
• 5-Methylpyrazole
• <3-Phenyl-pyrazol-5-yl>-saeure-aethylester
• 3-methyl-1H-pyrazole
• Pyrazole,5-methyl
• Pyrazole,3-methyl
• 5-phenyl-1(2)H-pyrazole-3-carboxylic acid ethyl ester
• 3-Phenyl-pyrazol-carbonsaeure-(5)-ethylester
• 3-(5)-methylpyrazole
• 3-methyl-pyrazol
• 5-methyl-pyrazol
• 5-ethoxycarbonyl-3-phenylpyrazole
• 3(5)-phenyl-5(3)-ethoxycarbonylpyrazole