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4-(5-Methoxy-1H-indol-3-yl)-butyric acid, also known as 5-Methoxytryptophol or 5-Methoxyindole-3-butanoic acid, is a chemical compound belonging to the class of indole alkaloids. It is derived from the amino acid tryptophan and plays a role in various physiological functions, such as mood regulation, sleep, appetite, and stress response. 4-(5-METHOXY-1H-INDOL-3-YL)-BUTYRIC ACID has been studied for its potential therapeutic effects in treating depression, anxiety, and other mental health disorders, and also serves as a precursor to the hormone melatonin, which regulates the sleep-wake cycle. Furthermore, it exhibits antioxidant and anti-inflammatory properties, garnering interest in the nutraceuticals and wellness industry.

83696-90-6

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83696-90-6 Usage

Uses

Used in Pharmaceutical Industry:
4-(5-METHOXY-1H-INDOL-3-YL)-BUTYRIC ACID is used as a therapeutic agent for the treatment of mental health disorders such as depression and anxiety. Its mood-regulating, sleep-promoting, and stress-relieving properties make it a promising candidate for pharmaceutical applications.
Used in Nutraceutical Industry:
4-(5-METHOXY-1H-INDOL-3-YL)-BUTYRIC ACID is used as a nutraceutical ingredient for its antioxidant and anti-inflammatory properties. It can be incorporated into wellness products to support overall health and well-being.
Used in Sleep Aid Products:
4-(5-METHOXY-1H-INDOL-3-YL)-BUTYRIC ACID is used as a precursor to melatonin in sleep aid products, helping to regulate the sleep-wake cycle and improve sleep quality.
Used in Antioxidant and Anti-Inflammatory Formulations:
4-(5-METHOXY-1H-INDOL-3-YL)-BUTYRIC ACID is used as an active ingredient in antioxidant and anti-inflammatory formulations, targeting various health conditions and promoting overall health.

Check Digit Verification of cas no

The CAS Registry Mumber 83696-90-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,3,6,9 and 6 respectively; the second part has 2 digits, 9 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 83696-90:
(7*8)+(6*3)+(5*6)+(4*9)+(3*6)+(2*9)+(1*0)=176
176 % 10 = 6
So 83696-90-6 is a valid CAS Registry Number.
InChI:InChI=1/C13H15NO3/c1-17-10-5-6-12-11(7-10)9(8-14-12)3-2-4-13(15)16/h5-8,14H,2-4H2,1H3,(H,15,16)

83696-90-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-(5-methoxy-1H-indol-3-yl)butanoic acid

1.2 Other means of identification

Product number -
Other names 5-Methoxyindole-3-butyricacid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:83696-90-6 SDS

83696-90-6Relevant academic research and scientific papers

Deciphering DNA-based asymmetric catalysis through intramolecular Friedel-Crafts alkylations

Park, Soyoung,Ikehata, Keiichi,Watabe, Ryo,Hidaka, Yuta,Rajendran, Arivazhagan,Sugiyama, Hiroshi

, p. 10398 - 10400,3 (2020/09/09)

We describe asymmetric intramolecular Friedel-Crafts alkylations with a DNA-based hybrid catalyst and propose a plausible binding model. This study shows promise for studying relationships between the helical chirality of DNA and enantioselectivity of the chemical reaction.

A Simple Procedure for Synthesis of Roxindole, a Dopamine D2-Receptor Agonist

Csende, Ferenc

, p. 253 - 254 (2007/10/03)

A modified convenient and high yielding synthetic route for the preparation of the dopamine agonist roxindole 1 is described. The key step in our method is the phase-transfer catalyzed reaction of γ-butyrolactone with 5-methoxyindole which results in the indolylbutyric acid derivative directly in one step.

Electrophilic Substitution in Indoles. Part 11. The Mechanism of Substitution in 5-Methoxyindoles

Clack, Denis W.,Jackson, Anthony H.,Prasitpan, Noojaree,Shannon, Patrick V. R.

, p. 909 - 916 (2007/10/02)

Deuterium labelling experiments show that the boron trifluoride-catalysed cyclisation at 90 deg C of 4-(5-methoxyindole-3-yl)butanol (1e) to 6-methoxytetrahydrocarbazole (11a) occurs by two simultaneous pathways.The main route (83.5percent) involves initial cyclisation at the 3-position of (1e) to give an intermediate spirocyclic indolenine which then rearranges to the tetrahydrocarbazole.The minor pathway (16.5percent) involves direct attack at the 2-position.A similar duality of mechanism of substitution applies to the 6-methoxy-, 4,6-dimethoxy-, and 5,6-dimethoxy-indole analogues for which the extent of substitution at the 2-position can be correlated with the calculated change in ?-electron density at the 2- and 3-positions for a series of methoxy-substituted 3-methyl-indoles.These calculations do not, however, fit the experimental findings for the 5-methoxy-derivative which appears to be anomalous, showing an unexpectedly high percentage of direct substitution at the 2-position.A possible explanation of this result is advanced.

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