850374-94-6

Basic information

• Product Name: 1-(TERT-BUTYL) 6-METHYL 3-IODO-1H-INDOLE-1,6-DICARBOXYLATE
• Synonyms: 1-(TERT-BUTYL) 6-METHYL 3-IODO-1H-INDOLE-1,6-DICARBOXYLATE;METHYL 3-IODOINDOLE-6-CARBOXYLATE, N-BOC PROTECTED;Methyl 3-iodo-1H-indole-6-carboxylate, N-BOC protected;Methyl 3-iodo-1H-indole-6-carboxylate, N-BOC protected 97%;1-(tert-Butoxycarbonyl)-3-iodo-6-(methoxycarbonyl)-1H-indole, Methyl 3-iodo-1H-indole-6-carboxylate, N-BOC protected;1-tert-Butyl 6-methyl 3-iodo-1H-indole-1,6-dicarboxylate 97%;1-tert-Butyl6-methyl3-iodo-1H-indole-1,6-dicarboxylate97%
• CAS NO: 850374-94-6
• Molecular Formula: C₁₅H₁₆INO₄
• Molecular Weight: 401.2
• Mol File: 850374-94-6.mol
• Article Data: 3

Chemical Properties

• Melting Point: 154 °C
• Boiling Point: 450.7°C at 760 mmHg
• Flash Point: 226.4°C
• Appearance: /
• Density: 1.57g/cm³
• Vapor Pressure: 2.59E-08mmHg at 25°C
• Refractive Index: 1.602
• CAS DataBase Reference: 1-(TERT-BUTYL) 6-METHYL 3-IODO-1H-INDOLE-1,6-DICARBOXYLATE(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(TERT-BUTYL) 6-METHYL 3-IODO-1H-INDOLE-1,6-DICARBOXYLATE(850374-94-6)
• EPA Substance Registry System: 1-(TERT-BUTYL) 6-METHYL 3-IODO-1H-INDOLE-1,6-DICARBOXYLATE(850374-94-6)

Safety Data

• Hazardous Substances Data: 850374-94-6(Hazardous Substances Data)

Usage

General Description

1-(tert-butyl) 6-methyl 3-iodo-1H-indole-1,6-dicarboxylate is a chemical compound with a molecular formula of C17H16IN2O4. It is a derivative of the indole class of organic compounds, containing a tert-butyl group, a methyl group, and an iodine atom attached to the indole ring. The compound is a diester, with two carboxylate groups attached to the indole ring. It is commonly used in organic synthesis and pharmaceutical research, particularly in the development of new drug compounds. The structure and properties of this chemical make it a valuable building block in the synthesis of various biologically active molecules.

InChI:InChI=1/C15H16INO4/c1-15(2,3)21-14(19)17-8-11(16)10-6-5-9(7-12(10)17)13(18)20-4/h5-8H,1-4H3

Upstream product

• 1670-82-2 Indole-6-carboxylic acid 
• 50820-65-0 indole-6-carboxylic acid methyl ester 
• 850374-98-0 3-iodo-1H-indole-6-carboxylic acid methyl ester 
• 24424-99-5 di-tert-butyl dicarbonate 

Downstream Products

• 1048039-45-7 tert-butyl 6-methyl 3-(((2S,3R)-2-(benzyloxycarbonyl)-1-((S)-1-phenylethyl)pyrrolidin-3-yl)methyl)-1H-indole-1,6-dicarboxylate 
• 1198592-01-6 1-(1,1-dimethylethyl) 6-methyl 3-phenyl-1H-indole-1,6-dicarboxylate 
• 1038997-75-9 3-phenylindole-6-carboxylic acid methyl ester 
• 1252780-52-1 methyl 3-(4-fluorophenyl)-1H-indole-6-carboxylate 
• 1252780-53-2 3-(4-fluoro-phenyl)-1H-indole-6-carboxylic acid 
• 1252780-54-3 methyl 3-(4-fluoro-phenyl)-1-methyl-1H-indole-6-carboxylate 
• 1252780-55-4 3-(4-fluoro-phenyl)-1-methyl-1H-indole-6-carboxylic acid 
• 1252782-08-3 methyl 1-methyl-3-phenyl-1H-indole-6-carboxylate 
• 1041205-61-1 1-methyl-3-phenyl-1H-indole-6-carboxylic acid 
• 1252782-10-7 3-(3-trifluoromethyl-phenyl)-1-methyl-1H-indole-6-carboxylic acid 
• 1373525-72-4 methyl 3-(3-trifluoromethyl-phenyl)-1-methyl-1H-indole-6-carboxylate 
• 1252782-13-0 methyl 3-(3-trifluoromethylphenyl)-1H-indole-6-carboxylate 
• 1252782-12-9 1-tert-butyl 6-methyl 3-(3-trifluoromethylphenyl)-1H-indole-1,6-dicarboxylate 
• 1252782-07-2 methyl 3-phenyl-1H-indole-6-carboxylate trifluoroacetate 

Relevant articles and documents

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The invention discloses an anti-HCV (hepatitis C) compound containing a five-membered heteroaromatic ring structure, as well as a preparation method and applications thereof. The compound has a structure shown as the formula I, the compound has excellent anti-HCV virus activity, can be used for preparing anti-HCV drugs, the prepared drugs can be applied by adopting oral administration, intravenous injection or intramuscular injection.

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