404888-00-2

Basic information

• Product Name: 3-FORMYL-4-HYDROXYINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
• Synonyms: 3-FORMYL-4-HYDROXYINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;4-Hydroxyindole-3-carboxaldehyde, N-BOC protected;4-Hydroxyindole-3-carboxaldehyde, N-BOC protected 98%;BOC-4-HYDROXYINDOLE-3-CARBOXALDEHYDE;1-Boc-3-formyl-4-hydroxyindole;3-Formyl-4-hydroxyindole-1-carboxylic acid t-butyl ester;Zinc02563744;tert-Butyl 3-formyl-4-hydroxy-1H-indole-1-carboxylate
• CAS NO: 404888-00-2
• Molecular Formula: C₁₄H₁₅NO₄
• Molecular Weight: 261.27
• Product Categories: API intermediates
• Mol File: 404888-00-2.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 435.8 °C at 760 mmHg
• Flash Point: 217.3 °C
• Appearance: /
• Density: 1.22 g/cm³
• Vapor Pressure: 3.34E-08mmHg at 25°C
• Refractive Index: 1.569
• PKA: 8.59±0.40(Predicted)
• CAS DataBase Reference: 3-FORMYL-4-HYDROXYINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 3-FORMYL-4-HYDROXYINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER(404888-00-2)
• EPA Substance Registry System: 3-FORMYL-4-HYDROXYINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER(404888-00-2)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 404888-00-2(Hazardous Substances Data)

Usage

General Description

3-Formyl-4-hydroxyindole-1-carboxylic acid tert-butyl ester is a chemical compound that is commonly used in organic synthesis. It is a tert-butyl ester derivative of the 3-formyl-4-hydroxyindole-1-carboxylic acid, which is a key intermediate in the synthesis of various indole-based molecules. 3-FORMYL-4-HYDROXYINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER is often used as a starting material for the preparation of pharmaceuticals, agrochemicals, and other biologically active compounds. It is also used as a building block in the production of dyes, pigments, and other fine chemicals. This chemical is known for its high reactivity and versatility, making it a valuable tool for chemists and researchers in various fields.

InChI:InChI=1/C14H15NO4/c1-14(2,3)19-13(18)15-7-9(8-16)12-10(15)5-4-6-11(12)17/h4-8,17H,1-3H3

Upstream product

• 2380-94-1 1H-indol-4-ol 
• 24424-99-5 di-tert-butyl dicarbonate 
• 81779-27-3 4-Hydroxyindole-3-carbaldehyde 
• 7042-71-9 4-benzyloxyindole-3-carbaldehyde 

Downstream Products

• 405893-10-9 (2-benzenesulfonyl-1-vinyl-2,7,8,9-tetrahydro-6-oxa-2-azabenzo[c,d]azulen-8-yl)dimethylamine 
• 405891-90-9 (2-benzenesulfonyl-2,7,8,9-tetrahydro-6-oxa-2-azabenzo[c,d]azulen-8-yl)dimethylamine 
• 405892-95-7 ((R)-1-phenylethyl)-(S)-2,7,8,9-tetrahydro-6-oxa-2-azabenzo[c,d]azulen-8-ylamine 
• 404888-03-5 4-benzyloxy-5-bromo-1-tert-butoxycarbonylindole-3-carbaldehyde 
• 404888-04-6 4-benzyloxy-5-bromoindole-3-carbaldehyde 
• 404888-01-3 4-benzyloxy-1-tert-butoxycarbonylindole-3-carbaldehyde 

Relevant articles and documents

Tricylic indole compounds having affinity for serotonin receptor

Having an affinity against serotonine receptors, compound (I) shown below is useful as a therapeutic agent against various kinds of diseases of central nervous systems. (wherein R1 is hydrogen; R2 is hydrogen or lower alkyl; R3 is hydrogen, —COOR12 and so on; R4 is hydrogen, lower alkyl and so on, or R3 and R4 taken together may form ═O or ═S; R5 is hydrogen, or R3 and R5 taken together may form a bond; R6 is hydrogen, —COOR24 and so on; R7 is hydrogen, halogen, lower alkyl and so on; R8 is hydrogen, lower alkyl, cycloalkyl and so on; R9, R10 and R11 are each independently hydrogen, halogen, lower alkyl and so on)