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3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯

更新时间:2025-09-04 22:01:08

3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯结构式
3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯结构式
品牌特惠专场
常用名 3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯 英文名 4,5,6,7-tetrahydro-3-methyl-4-oxo-indole-2-carboxylicaciethylester
CAS号 7272-58-4 分子量 221.25200
密度 1.217g/cm3 沸点 428.2ºC at 760 mmHg
分子式 C12H15NO3 熔点 N/A
MSDS N/A 闪点 212.8ºC

 名称

中文名 3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯
英文名 ethyl 3-methyl-4-oxo-1,5,6,7-tetrahydroindole-2-carboxylate
中文别名 4,5,6,7-四氢-3-甲基-4-氧吲哚-2-羧酸乙酯
英文别名 更多

 物理化学性质

密度 1.217g/cm3
沸点 428.2ºC at 760 mmHg
分子式 C12H15NO3
分子量 221.25200
闪点 212.8ºC
精确质量 221.10500
PSA 59.16000
LogP 2.01880
InChIKey VQLLFMATRGJDCH-UHFFFAOYSA-N
SMILES CCOC(=O)c1[nH]c2c(c1C)C(=O)CCC2
折射率 1.56

 合成线路

~51%

3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯结构式

3-甲基-4-氧-4,5,6,...

7272-58-4

文献:Elliott, Luke D.; Berry, Malcolm; Orr-Ewing, Andrew J.; Booker-Milburn, Kevin I. Journal of the American Chemical Society, 2007 , vol. 129, # 11 p. 3078 - 3079

~61%

3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯结构式

3-甲基-4-氧-4,5,6,...

7272-58-4

文献:Barraja, Paola; Diana, Patrizia; Montalbano, Alessandra; Carbone, Anna; Cirrincione, Girolamo; Viola, Giampietro; Salvador, Alessia; Vedaldi, Daniela; Dall'Acqua, Francesco Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 22 p. 9668 - 9683

~34%

3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯结构式

3-甲基-4-氧-4,5,6,...

7272-58-4

文献:Elghamry, Ibrahim Synthetic Communications, 2002 , vol. 32, # 6 p. 897 - 902

~45%

3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯结构式

3-甲基-4-氧-4,5,6,...

7272-58-4

文献:Lash, Timothy D.; Bladel, Karla A.; Shiner, Craig M.; Zajeski, Donna L.; Balasubramaniam, Rajiv P. Journal of Organic Chemistry, 1992 , vol. 57, # 18 p. 4809 - 4820

~19%

3-甲基-4-氧-4,5,6,7-四氢-1氢-吲哚-2-甲酸乙酯结构式

3-甲基-4-氧-4,5,6,...

7272-58-4

文献:Gelas-Mialhe, Yvonne; Mabiala, Gaston; Vessiere, Roger Journal of Organic Chemistry, 1987 , vol. 52, # 24 p. 5395 - 5400

 靶点实验

查看更多实验

实验名称:Inhibition of the Burkholderia mallei acyl-homoserine lactone synthase BmaI1
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:autoinducer synthetase family protein [Burkholderia mallei ATCC 23344]
External Id:HMS1126
实验名称:Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:HCMV UL50
External Id:HMS1262
实验名称:Screen for inhibitors of RMI FANCM (MM2) intereaction
来源:11908
靶标:N/A
External Id:RMI-FANCM-MM2
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:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
实验名称:A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:Chain A, Poliovirus Polymerase With Gtp
External Id:HMS750
实验名称:qHTS assay for inhibitors of human lactate dehydrogenase
来源:NCGC
靶标:N/A
External Id:LDHA
实验名称:Primary qHTS for inhibitors of NSP2Pro chikungunya virus (CHIKV)
来源:NCGC
External Id:APP-Toga-CHIKV-nsp2-p
实验名称:Primary qHTS for Inhibitors of N-terminal methyltransferase 1 (NTMT1): MTaseGlo Assay
来源:NCGC
External Id:NTMT1-p-MTaseGlo
实验名称:Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
来源:NCGC
External Id:stopgo-p2-SytraCBC-dual-FF
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 英文别名

ethyl 3-methyl-4-oxo-4,5,6-tetrahydro-1H-indole-2-carboxylate
4,5,6,7-Tetrahydro-3-methyl-4-oxo-indole-2-carboxylic acid ethyl ester
3-methyl-4-oxo-4,5,6,7-tetrahydro-indole-2-carboxylic acid ethyl ester
ethyl 3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
2-carbethoxy-3-methyl-4-oxo-4,5,6,7-tetrahydroindole
F1754-0022
2-Carbethoxy-3-methyl-4-keto-4,5,6,7-tetrahydro-indol
ethyl 3-methyl-4-oxo-4,5,6,7-tetrahydroindole-2-carboxylate
INDOLE-2-CARBOXYLIC ACID,4,5,6,7-TETRAHYDRO-3-METHYL-4-OXO-,ETHYL ESTER
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