191162-40-0

Basic information

• Product Name: 1-METHYL-1H-INDOLE-2-BORONIC ACID 2,2-DIMETHYL PROPANE DIOL-1,3-CYCLIC ESTER
• Synonyms: N-METHYLINDOLE-2-BORONIC ACID;N-METHYL-2-INDOLEBORONIC ACID;AKOS BRN-0885;1-METHYL-1H-INDOLE-2-BORONIC ACID;1-METHYL-1H-INDOLE-2-BORONIC ACID 2,2-DIMETHYL PROPANE DIOL-1,3-CYCLIC ESTER;(1-METHYL-1H-IND-2-YL)BORONIC ACID;(1-METHYL-1H-INDOL-2-YL)BORONIC ACID;1-Methyl-1H-indole-2-boronic acid 95%
• CAS NO: 191162-40-0
• Molecular Formula: C₉H₁₀BNO₂
• Molecular Weight: 174.99
• Product Categories: blocks;BoronicAcids;IndolesOxindoles
• Mol File: 191162-40-0.mol
• Article Data: 4

Chemical Properties

• Melting Point: 108-112
• Boiling Point: 402.572 °C at 760 mmHg
• Flash Point: 197.269 °C
• Appearance: /
• Density: 1.16
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.571
• Storage Temp.: Keep Cold
• PKA: 9.39±0.30(Predicted)
• CAS DataBase Reference: 1-METHYL-1H-INDOLE-2-BORONIC ACID 2,2-DIMETHYL PROPANE DIOL-1,3-CYCLIC ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 1-METHYL-1H-INDOLE-2-BORONIC ACID 2,2-DIMETHYL PROPANE DIOL-1,3-CYCLIC ESTER(191162-40-0)
• EPA Substance Registry System: 1-METHYL-1H-INDOLE-2-BORONIC ACID 2,2-DIMETHYL PROPANE DIOL-1,3-CYCLIC ESTER(191162-40-0)

Safety Data

• Hazard Codes: Xi
• Statements: 37/38-41
• Safety Statements: 26-39
• Hazardous Substances Data: 191162-40-0(Hazardous Substances Data)

Usage

Uses

Reactant for Suzuki-Miyaura coupling. It ia an active Pharmaceutical ingredient hence used as pharmaceutical intermediates. Also used as rawv material in organic synthesis.

InChI:InChI=1/C9H10BNO2/c1-11-8-5-3-2-4-7(8)6-9(11)10(12)13/h2-6,12-13H,1H3

Upstream product

• 603-76-9 1-methylindole 
• 5419-55-6 Triisopropyl borate 
• 121-43-7 Trimethyl borate 

Downstream Products

• 65610-86-8 2-(2-aminophenyl)-1-methyl-1H-indole 
• 1361379-27-2 (2-chlorophenyl)-N-[5-(1-methylindol-2-yl)(1,3-thiazol-2-yl)]carboxamide 
• 1146395-47-2 2-[4-(1-methyl-1H-indol-2-yl)phenyl]-N-{(1R)-1-[5-(2,2,2-trifluoroethoxy)pyridin-2-yl]ethyl}acetamide 

Relevant articles and documents

JAK INHIBITOR

A JAK inhibitor comprising, as an active ingredient, a nitrogen-containing heterocyclic compound represented by formula (I) {wherein W represents a nitrogen atom or -CH-; X represents -C (=O) - or -CHR4- (wherein R4 represents a hydrogen atom, or the like); R1 represents the formula described below [wherein Q1 represents-CR8-(wherein R8 represents a hydrogen atom, substituted or unsubstituted lower alkyl, or the like); Q2 represents -NR15- (wherein R15 represents a hydrogen atom, substituted or unsubstituted lower alkyl, or the like); and R5 and R6 may be the same or different and each represents a hydrogen atom, halogen, carboxy, substituted or unsubstituted lower alkyl, or the like], or the like; and R2 and R3 may be the same or different and each represents a hydrogen atom, halogen, substituted or unsubstituted lower alkyl, or the like} or a pharmaceutically acceptable salt thereof.

3-PYRIDYLOXYMETHYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION

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