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1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)

更新时间:2025-10-06 19:57:01

1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)结构式
1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)结构式
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常用名 1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl) 英文名 1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)
CAS号 40588-50-9 分子量 395.44800
密度 1.27g/cm3 沸点 550.9ºC at 760 mmHg
分子式 C23H25NO5 熔点 N/A
MSDS N/A 闪点 211.3ºC

 名称

英文名 3,3,6,6-tetramethyl-9-(3-nitrophenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
英文别名 更多

 物理化学性质

密度 1.27g/cm3
沸点 550.9ºC at 760 mmHg
分子式 C23H25NO5
分子量 395.44800
闪点 211.3ºC
精确质量 395.17300
PSA 89.19000
LogP 5.51820
InChIKey FKQZCAOBKRTYCO-UHFFFAOYSA-N
SMILES CC1(C)CC(=O)C2=C(C1)OC1=C(C(=O)CC(C)(C)C1)C2c1cccc([N+](=O)[O-])c1
折射率 1.601

 合成线路

~95%

1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)结构式

1H-Xanthene-1,8...

40588-50-9

文献:Shirini, Frahad; Abedini, Masoumeh; Pourhasan, Reyhaneh Dyes and Pigments, 2013 , vol. 99, # 1 p. 250 - 255

~93%

1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)结构式

1H-Xanthene-1,8...

40588-50-9

文献:Rong, Liangce; Li, Xiaoyue; Wang, Haiying; Shi, Daqing; Tu, Shujiang; Zhuang, Qiya Synthetic Communications, 2006 , vol. 36, # 16 p. 2345 - 2353

~%

1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)结构式

1H-Xanthene-1,8...

40588-50-9

文献:Han, Guang-Fan; Cui, Bin; Chen, Li-Zhuang; Hu, Xiao-Lei Journal of Heterocyclic Chemistry, 2012 , vol. 49, # 1 p. 195 - 199

~%

1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)结构式

1H-Xanthene-1,8...

40588-50-9

文献:Horning; Horning Journal of Organic Chemistry, 1946 , vol. 11, p. 95,97, 98

~%

1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)结构式

1H-Xanthene-1,8...

40588-50-9

文献:Horning; Horning Journal of Organic Chemistry, 1946 , vol. 11, p. 95,97, 98

~%

1H-Xanthene-1,8(2H)-dione,3,4,5,6,7,9-hexahydro-3,3,6,6-tetramethyl-9-(3-nitrophenyl)结构式

1H-Xanthene-1,8...

40588-50-9

文献:Horning; Horning Journal of Organic Chemistry, 1946 , vol. 11, p. 95,97, 98

 靶点实验

查看更多实验

实验名称:Antiproliferative activity against human K562 cells after 24 hrs by MTT assay
来源:ChEMBL
靶标:K562
External Id:CHEMBL1960492
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:Antiproliferative activity against human COLO205 cells after 24 hrs by MTT assay
来源:ChEMBL
靶标:COLO 205
External Id:CHEMBL1960404
实验名称:Antiproliferative activity against human IMR32 cells after 24 hrs by MTT assay
来源:ChEMBL
靶标:IMR-32
External Id:CHEMBL1960403
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 英文别名

hms617n13
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