3-(2,5-二氧代-2,5-二氢-1H-吡咯-1-基)苯甲酸

• 常用名: 3-(2,5-二氧代-2,5-二氢-1H-吡咯-1-基)苯甲酸
• 英文名: 3-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)benzoic acid
• CAS号: 17057-07-7
• 分子量: 217.178
• 密度: 1.5±0.1 g/cm3
• 沸点: 455.2±28.0 °C at 760 mmHg
• 分子式: C₁₁H₇NO₄
• 熔点: N/A
• 闪点: 229.1±24.0 °C

用途

3-Maleimidobenzoic acid 是一种蛋白质交联剂。

名称

• 中文名: m-N-马来酰亚氨基苯甲酸
• 英文名: 3-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)-benzoic acid
• 中文别名: 3-(2,5-二氧代-2,5-二氢-1H-1-吡咯基)苯甲酸 | 3-N-马来酰亚氨基苯甲酸

生物活性

• 描述: 3-Maleimidobenzoic acid 是一种蛋白质交联剂。
• 相关类别:
  研究领域 >> 其他
• 参考文献:

  [1]. Kratz F, et al. Preparation, characterization and in vitro efficacy of albumin conjugates of doxorubicin. Biol Pharm Bull. 1998 Jan;21(1):56-61.

物理化学性质

• 密度: 1.5±0.1 g/cm3
• 沸点: 455.2±28.0 °C at 760 mmHg
• 分子式: C₁₁H₇NO₄
• 分子量: 217.178
• 闪点: 229.1±24.0 °C
• 精确质量: 217.037506
• PSA: 74.68000
• LogP: 0.77
• InChIKey: ZJGBFJBMTKEFNQ-UHFFFAOYSA-N
• SMILES: O=C(O)c1cccc(N2C(=O)C=CC2=O)c1
• 蒸汽压: 0.0±1.2 mmHg at 25°C
• 折射率: 1.669
• 储存条件: 2-8°C
• 计算化学:

  1.疏水参数计算参考值（XlogP）:无

  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:2

  5.互变异构体数量:无

  6.拓扑分子极性表面积:74.7

  7.重原子数量:16

  8.表面电荷:0

  9.复杂度:356

  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

MSDS

MSDS英文版

安全信息

• 危害码 (欧洲): Xi: Irritant;
• 海关编码: 2925190090

海关

• 海关编码: 2925190090
• 中文概述: 2925190090 其他酰亚胺及其衍生物盐. 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
• Summary: 2925190090 other imides and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

靶点实验

查看更多实验

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：qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in... 来源：NCGC 靶标：TDP1 protein [Homo sapiens] External Id：TDP1100

实验名称：qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in... 来源：NCGC 靶标：TDP1 protein [Homo sapiens] External Id：TDP1101

实验名称：Schnurri-3 Inhibitors: specific inducers of adult bone formation Measured in Cell-Bas... 来源：Broad Institute 靶标：N/A External Id：2134-01_Inhibitor_SinglePoint_HTS_Activity_Set2

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：Inhibitory activity against Prostaglandin G/H synthase; NS=no significant inhibition ... 来源：ChEMBL 靶标：Prostaglandin G/H synthase 1 External Id：CHEMBL763069

实验名称：qHTS for Inhibitors of AMA1-RON; Towards Development of Antimalarial Drug Lead: Prima... 来源：NCGC 靶标：apical membrane antigen 1, AMA1 [Plasmodium falciparum 3D7] External Id：AMA1100

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：abhydrolase domain-containing protein 4 isoform 1 [Mus musculus] External Id：ABHD4_INH_FP_1536_1X%INH PRUN

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英文别名

• EINECS 241-118-4
• 3-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid
• 3-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)benzoic acid
• 3-MALEIMIDOBENZOIC ACID
• MFCD00022572
• 3-(2,5-dioxopyrrol-1-yl)benzoic acid