1-苯基-5-三氟甲基-吡唑-4-羧肼

• 常用名: 1-苯基-5-三氟甲基-吡唑-4-羧肼
• 英文名: 1-PHENYL-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOHYDRAZIDE
• CAS号: 175137-32-3
• 分子量: 270.21100
• 密度: 1.53g/cm3
• 沸点: 503.6ºC at 760mmHg
• 分子式: C₁₁H₉F₃N₄O
• 熔点: 153-155ºC
• 闪点: 258.3ºC

1-苯基-5-三氟甲基-吡唑-4-羧肼名称

• 中文名: 1-苯基-5-三氟甲基-吡唑-4-羧肼
• 英文名: 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbohydrazide
• 中文别名: 1-苯基-5-(三氟甲基)-1H-吡唑-4-碳酰肼

1-苯基-5-三氟甲基-吡唑-4-羧肼物理化学性质

• 密度: 1.53g/cm3
• 沸点: 503.6ºC at 760mmHg
• 熔点: 153-155ºC
• 分子式: C₁₁H₉F₃N₄O
• 分子量: 270.21100
• 闪点: 258.3ºC
• 精确质量: 270.07300
• PSA: 72.94000
• LogP: 2.58580
• InChIKey: HHPIIZJILLCOBV-UHFFFAOYSA-N
• SMILES: NNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F
• 蒸汽压: 2.87E-10mmHg at 25°C
• 折射率: 1.595
• 计算化学:

  1.疏水参数计算参考值（XlogP）:1.3

  2.氢键供体数量:2

  3.氢键受体数量:6

  4.可旋转化学键数量:2

  5.互变异构体数量:2

  6.拓扑分子极性表面积:72.9

  7.重原子数量:19

  8.表面电荷:0

  9.复杂度:330

  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

1-苯基-5-三氟甲基-吡唑-4-羧肼MSDS

1-苯基-5-三氟甲基-吡唑-4-羧肼MSDS英文版

1-苯基-5-三氟甲基-吡唑-4-羧肼安全信息

• 危害码 (欧洲): Xi: Irritant;
• 风险声明 (欧洲): R36/37/38
• 安全声明 (欧洲): S26-S37/39
• 海关编码: 2933199090

1-苯基-5-三氟甲基-吡唑-4-羧肼海关

• 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%

1-苯基-5-三氟甲基-吡唑-4-羧肼靶点实验

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：Dicer-mediated maturation of pre-microRNA 来源：Center for Chemical Genomics, University of Michigan 靶标：N/A External Id：TargetID_659_CEMA

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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1-苯基-5-三氟甲基-吡唑-4-羧肼英文别名

• 1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
• HMS552C10