2-氨基-4-苯基-6-三氟甲基嘧啶

• 常用名: 2-氨基-4-苯基-6-三氟甲基嘧啶
• 英文名: 2-Amino-4-phenyl-6-(trifluoromethyl)pyrimidine
• CAS号: 26974-09-4
• 分子量: 239.19700
• 密度: 1.351g/cm3
• 沸点: 397.5ºC at 760mmHg
• 分子式: C₁₁H₈F₃N₃
• 熔点: 131-133ºC
• 闪点: 194.2ºC

2-氨基-4-苯基-6-三氟甲基嘧啶名称

• 中文名: 2-氨基-4-苯基-6-三氟甲基嘧啶
• 英文名: 4-phenyl-6-(trifluoromethyl)pyrimidin-2-amine
• 中文别名: 4-苯基-6-三氟甲基-2-嘧啶基胺

2-氨基-4-苯基-6-三氟甲基嘧啶物理化学性质

• 密度: 1.351g/cm3
• 沸点: 397.5ºC at 760mmHg
• 熔点: 131-133ºC
• 分子式: C₁₁H₈F₃N₃
• 分子量: 239.19700
• 闪点: 194.2ºC
• 精确质量: 239.06700
• PSA: 51.80000
• LogP: 3.32580
• InChIKey: ZHXBPRJAAQLLMC-UHFFFAOYSA-N
• SMILES: Nc1nc(-c2ccccc2)cc(C(F)(F)F)n1
• 蒸汽压: 0.005mmHg at 25°C
• 折射率: 1.524
• 分子结构:

  1、 摩尔折射率：56.24

  2、 摩尔体积（cm³/mol）：176.9

  3、 等张比容（90.2K）：451.9

  4、 表面张力（dyne/cm）：42.5

  5、 极化率（10-24cm3）：22.29

• 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:6

  4.可旋转化学键数量:1

  5.互变异构体数量:3

  6.拓扑分子极性表面积51.8

  7.重原子数量:17

  8.表面电荷:0

  9.复杂度:251

  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

• 更多:

  1. 熔点（ºC）：131-133

2-氨基-4-苯基-6-三氟甲基嘧啶MSDS

2-氨基-4-苯基-6-三氟甲基嘧啶MSDS英文版

2-氨基-4-苯基-6-三氟甲基嘧啶安全信息

• 危害码 (欧洲): Xi: Irritant;
• 风险声明 (欧洲): 36/37/38
• 安全声明 (欧洲): S24/25
• 海关编码: 2933599090

2-氨基-4-苯基-6-三氟甲基嘧啶海关

• 海关编码: 2933599090
• 中文概述: 2933599090. 其他结构上有嘧啶环的化合物(包括其他结构上有哌嗪环的化合物. 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: 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2-氨基-4-苯基-6-三氟甲基嘧啶靶点实验

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：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

实验名称：Absorbance-based primary biochemical high throughput screening assay to identify acti... 来源：The Scripps Research Institute Molecular Screening Center 靶标：caspase-3 preproprotein [Homo sapiens] External Id：PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN

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2-氨基-4-苯基-6-三氟甲基嘧啶英文别名

• 4-phenyl-6-(trifluoromethyl)pyrimidine-2-ylamine
• 4-phenyl-6-trifluoromethyl-pyrimidin-2-ylamine
• 4-Phenyl-6-(trifluoromethyl)-2-pyrimidinylamine
• 2-Amino-4-phenyl-6-(trifluoromethyl)pyrimidine
• 4-trifluoromethyl-6-phenyl-2-aminopyrimidine