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3-Hydroxy-6-methoxy-2H-1-benzopyran-2-one, also known as scopoletin, is a naturally occurring organic compound belonging to the class of coumarins. It is a white crystalline substance with a molecular formula of C10H8O4 and a molecular weight of 192.17 g/mol. Scopoletin is found in various plants, including tobacco, carrots, and celery, and is known for its antioxidant, anti-inflammatory, and antimicrobial properties. It is also used as a research tool in the study of enzyme inhibition and as a marker for the quality control of herbal medicines. The compound has a role in the biosynthesis of other natural products and can be used as a starting material for the synthesis of various pharmaceuticals and agrochemicals.

3450-77-9

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3450-77-9 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 3450-77-9 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,4,5 and 0 respectively; the second part has 2 digits, 7 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 3450-77:
(6*3)+(5*4)+(4*5)+(3*0)+(2*7)+(1*7)=79
79 % 10 = 9
So 3450-77-9 is a valid CAS Registry Number.

3450-77-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-hydroxy-6-methoxy-chromen-2-one

1.2 Other means of identification

Product number -
Other names 3-Hydroxy-6-methoxy-chromen-2-one

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:3450-77-9 SDS

3450-77-9Downstream Products

3450-77-9Relevant academic research and scientific papers

A novel class of human 15-LOX-1 inhibitors based on 3-hydroxycoumarin

Alavi, Seyed Jamal,Sadeghian, Hamid,Seyedi, Seyed Mohammad,Salimi, Alireza,Eshghi, Hossein

, p. 1125 - 1132 (2018/03/02)

Inflammations, sensitivities, and some cancers in mammals are intimately linked to the activity of lipo-oxygenase enzymes. Owing to the importance of these enzymes, mechanistic studies, product analysis, and synthesis of inhibitors have expanded. In this study, a series of hydroxycoumarins, methoxy-3-hydroxy coumarins, and 7-alkoxy-3-hydroxy coumarins were synthesized and evaluated as potential inhibitors of human 15-LOX-1. Among the synthetic coumarins, 7-methoxy-3-hydroxycoumarin derivative demonstrated potent inhibitory activity and the compound, 5f, showed the best result. Radical scavenging assessment, IC50, HNMR, and DPPH bleaching results indicate that the electronic properties are the major factors for the lipo-oxygenase inhibition potency of the synthetic coumarins. Based on the theoretical studies, it was suggested that the mesomeric effect of the substituent at the seventh position of the benzene ring is one of the major factors in the stability of the oxy-radical intermediate.

New efficient synthesis of pyrido[2,3-c] and pyrido[3,2-c]coumarin derivatives

Pavé, Grégoire,Chalard, Pierre,Viaud-Massuard, Marie-Claude,Troin, Yves,Guillaumet, Gérald

, p. 987 - 990 (2007/10/03)

Various substituted pyrido[2,3-c] and pyrido[3,2-c]coumarins are efficiently prepared in three steps from 3- and 4-hydroxycoumarins, respectively and protected β-aminoketones.

Reaction of aryl-2-hydroxypropenoic derivatives with boron tribromide

Dupont, Romain,Cotelle, Philippe

, p. 597 - 600 (2007/10/03)

(Z)-Mono, di or trimethoxyphenyl-2-hydroxypropenoic acids 1a-d gave mixtures of (E) and (Z) mono, di or trihydroxyphenyl-2-hydroxypropenoic acids 2a-d when treated with boron tibromide. The isomerisation proceeds during the work-up and depends on the duration of the hydrolysis and the number of oxygens on the aromatic ring. When the aromatic ring was substituted with a methoxy group at the ortho position, a cyclisation occurs, and 3-hydroxycoumarins 3 and benzofuran-2-carboxylic acids 4 can be obtained. 3-Hydroxycoumarin 3a can also be obtained almost quatitatively from the reaction of methyl 3-(2-methoxyphenyl)-2,3-epoxypropanoate with boron tribromide.

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