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methyl 7-hydroxy-2-oxo-2H-chromene-6-carboxylate is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

52591-14-7

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52591-14-7 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 52591-14-7 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,2,5,9 and 1 respectively; the second part has 2 digits, 1 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 52591-14:
(7*5)+(6*2)+(5*5)+(4*9)+(3*1)+(2*1)+(1*4)=117
117 % 10 = 7
So 52591-14-7 is a valid CAS Registry Number.

52591-14-7SDS

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 methyl 7-hydroxy-2-oxochromene-6-carboxylate

1.2 Other means of identification

Product number -
Other names 6-Carbomethoxy-7-hydroxycoumarin

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:52591-14-7 SDS

52591-14-7Relevant academic research and scientific papers

Study of plant coumarins 1. Transformations of peucedanin

Osadchii,Shul'ts,Shakirov,Tolstikov

, p. 375 - 379 (2006)

The structure of 2-bromooreoselon, which was prepared by bromination of peucedanin or oreoselon with molecular bromine, was established. The compositions and structures of the reaction products of this bromide with amines, such as pyridine, triethylamine, and morpholine, as well as with sodium acetate and potassium hydroxide were studied. The reaction of peucedanin with m-chloroperoxybenzoic acid affords peuruthenicin isobutyrate.

Secondary metabolites of Peucedanum tauricum fruits

Tesso, Hailemichael,Koenig, Wilfried A.,Kubeczka, Karl-Heinz,Bartnik, Magdalena,Glowniak, Kazimierz

, p. 707 - 713 (2005)

From the essential oil of fruits of Peucedanum tauricum Bieb., two guaiane type sesquiterpene hydrocarbons guaia-1(10),11-diene (1) and guaia-9,11-diene (2) were identified. The structures of 1 and 2 were assigned by 1D and 2D NMR analysis. The relative configurations of the compounds were established by 2D-NOESY experiments while the absolute configurations were deduced through chemical correlations with (+)-γ-gurjunene (9) and capillary GC analysis using modified cyclodextrins as the stationary phases. From the dichloromethane extract of the less volatile fraction of the fruits, coumarins, viz. peucedanin (3), oxypeucedanin hydrate (4) and officinalin isobutyrate (5) were isolated. Compound 5 was confirmed to be 6-carbomethoxy-7-isobutyroxycoumarin by its 1D and 2D NMR data as well as by conversion into officinalin (7) by alkaline hydrolysis. Peuruthenicin, a positional isomer of officinalin, is assigned structure 8 on spectral basis. Bergapten (6) was identified by its mass spectrum. This is the first report on the isolation of compounds 4 and 5 from P. tauricum.

Synthesis, in vivo anticoagulant evaluation and molecular docking studies of bicoumarins obtained from furocoumarin peucedanin

Lipeeva, Alla V.,Khvostov, Mikhail V.,Baev, Dmitry S.,Shakirov, Makhmut M.,Tolstikova, Tatijana G.,Shults, Elvira E.

, p. 674 - 683 (2016/10/18)

Background: Synthesis of 7,7-linked bicoumarins, 3,3-linked bi(2-isopropyl)psoralens as well as 1H-1,2,3-triazole linked coumarin-2,3-dihydrofurocoumarin and furocoumarin-2,3-dihydrofurocoumarin hybrids was performed by two alternative pathways, either involving a catalyzed transformations of the ethynyl derivatives of plant coumarins -peucedanin or peuruthenicin. Objective and Methods: The Sonogashira reaction of 7-ethynyl coumarins or 3-ethynyl-2-isopropylpsoralen with the subsequent coumarin triflates led to 7,7-linked bicoumarins or 3,3-linked bipsoralens. 1,2,3-Triazole linked coumarin-2,3-dihydrofurocoumarin or furocoumarin-2,3-dihydrofurocoumarin hybrids were synthesized by a regioselective Cu-catalyzed cycloaddition reaction of 2-azidooreoselone with 7-alkynylcoumarins or 3-ethynyl-2-isopropylpsoralen. Results: Pharmacological screening of synthesized bicoumarins for anticoagulant activity in vivo revealed that coumarin-dihydrofurocoumarin hybrids linked with a 1,2,3-triazole ring 20 and 22 were the most active compounds. The presented prothrombin time (PT) values comparable to the reference drug warfarin in a dose 100 mg/kg. Docking studies were undertaken to gain insight into the possible binding mode of these compounds with the coagulation factor Xa (FXa) binding site. Conclusion: The moderate toxicity of compounds 20 and 22 (LD50 valuewas more than 3000 mg/kg) encouraged the further design of therapeutically relevant analogues based on these novel type of coumarin hybrids.

Study of plant coumarins: X*.peurutenicin trifl ate in cross-coupling reactions

Makhneva,Lipeeva,Shults,Shakirov,Tolstikov

, p. 1094 - 1102 (2013/01/15)

By Suzuki cross-coupling reaction of peurutenicin trifl ate with arylboric, furanylboric, pyridinylboric, and indolylboric acids the corresponding 7-aryl(hetaryl)coumarins were synthesized. The high activity of hetarylsubstituted boric acids in the Suzuki

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