2-苯甲酰-4-溴苯胺

• 常用名: 2-苯甲酰-4-溴苯胺
• 英文名: 2-Benzoyl-4-bromoaniline
• CAS号: 39859-36-4
• 分子量: 276.129
• 密度: 1.5±0.1 g/cm3
• 沸点: 424.6±35.0 °C at 760 mmHg
• 分子式: C₁₃H₁₀BrNO
• 熔点: N/A
• 闪点: 210.6±25.9 °C

2-苯甲酰-4-溴苯胺名称

• 中文名: 5-溴-2-氨基二苯甲酮
• 英文名: 2-Benzoyl-4-bromoaniline
• 中文别名: 2-氨基-5-溴二苯甲酮 | 2-氨基-5-溴二苯甲酮 | 2-苯甲酰-4-溴苯胺 | 2-苯甲酰-4-溴苯胺

2-苯甲酰-4-溴苯胺物理化学性质

• 密度: 1.5±0.1 g/cm3
• 沸点: 424.6±35.0 °C at 760 mmHg
• 分子式: C₁₃H₁₀BrNO
• 分子量: 276.129
• 闪点: 210.6±25.9 °C
• 精确质量: 274.994568
• PSA: 43.09000
• LogP: 3.81
• InChIKey: LXJVUGANBDAASB-UHFFFAOYSA-N
• SMILES: Nc1ccc(Br)cc1C(=O)c1ccccc1
• 蒸汽压: 0.0±1.0 mmHg at 25°C
• 折射率: 1.652
• 储存条件: 2-8°C
• 计算化学:

  1.疏水参数计算参考值（XlogP）:3.8

  2.氢键供体数量:1

  3.氢键受体数量:2

  4.可旋转化学键数量:2

  5.互变异构体数量:4

  6.拓扑分子极性表面积:43.1

  7.重原子数量:16

  8.表面电荷:0

  9.复杂度:250

  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-苯甲酰-4-溴苯胺安全信息

• 危害码 (欧洲): Xi
• 风险声明 (欧洲): 36/37/38
• 安全声明 (欧洲): 26-36/37/39
• 海关编码: 2922399090

2-苯甲酰-4-溴苯胺海关

• 海关编码: 2922399090
• 中文概述: 2922399090 其他氨基醛、氨基酮及其盐（包括氨基醌及其盐，但含有一种以上含氧基的除外）. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
• 申报要素: 品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
• Summary: 2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

2-苯甲酰-4-溴苯胺靶点实验

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：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

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2-苯甲酰-4-溴苯胺英文别名

• (2-Amino-5-bromophenyl)(phenyl)methanone
• MFCD00059962
• (2-amino-5-bromophenyl)-phenylmethanone
• ZR DE BVR