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Butanoic acid, 3-hydroxy-3-methyl-2-oxo-, also known as 3-hydroxyisovaleric acid or 3-hydroxy-3-methyl-2-oxobutanoic acid, is a chemical compound with the molecular formula C5H10O4. It is a derivative of butanoic acid, featuring a hydroxyl group (-OH) at the 3rd carbon and a ketone group (C=O) at the 2nd carbon. This organic acid is a key intermediate in the metabolism of certain amino acids, such as leucine and isoleucine, and plays a role in the citric acid cycle. It is also found in various natural products and can be used as a building block in the synthesis of pharmaceuticals and other organic compounds.

6546-31-2

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6546-31-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 6546-31-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,5,4 and 6 respectively; the second part has 2 digits, 3 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 6546-31:
(6*6)+(5*5)+(4*4)+(3*6)+(2*3)+(1*1)=102
102 % 10 = 2
So 6546-31-2 is a valid CAS Registry Number.

6546-31-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-hydroxy-3-methyl-2-oxobutanoic acid

1.2 Other means of identification

Product number -
Other names Butanoic acid,3-hydroxy-3-methyl-2-oxo

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:6546-31-2 SDS

6546-31-2Downstream Products

6546-31-2Relevant academic research and scientific papers

Palladium-catalyzed regioselective arylation of imidazo[1,2-b][1,2,4] triazine: Synthesis of an α2/3-selective GABA agonist

Gauthier Jr., Donald R.,Limanto, John,Devine, Paul N.,Desmond, Richard A.,Szumigala Jr., Ronald H.,Foster, Bruce S.,Volante

, p. 5938 - 5945 (2007/10/03)

A convergent, practical, and efficient synthesis of 2′,6-difluoro- 5′-[3-(1-hydroxy-1-methylethy)-imidazo[1,2-b][1,2,4]triazin-7-yl] biphenyl-2-carbonitrile (1), an orally active GABAA dag-selective agonist, is described. The seven-step, chromatography-fr

Structure-Activity Studies with the αβ-Dihydroxyacid Dehydratase of Salmonella typhimurium

Armstrong, Frank B.,Lipscomb, Elizabeth L.,Crout, David H. G.,Morgan, Phillip J.

, p. 691 - 696 (2007/10/02)

(2RS,3RS)- and (2RS,3SR)-2,3-Dihydroxybutanoic acids, (2R,3R)-2,3-dihydroxy-3-methylpentanoic acid, (2RS)-2-ethyl-2,3-dihydroxypentanoic acid, (2RS,3RS)- and (2RS,3SR)-2,3-dihydroxy-3-methylhexanoic acids, and (2RS,3RS)- and (2RS,3SR)-2,3-dihydroxy-3-methylheptanoic acids were synthesised.These acids, as well as (RS)-2,3-dihydroxy-3-methylbutanoic acid and (RS)-glyceric acid were tested as substrates for the αβ-dihydroxyacid dehydratase of the isoleucine-valine biosynthetic pathway of Salmonella typhimurium.For acids having a propyl group at C-3, the activities were greatly reduced compared with those obtained for the natural substrates (2R,3R)-2,3-dihydroxy-3-methylpentanoic acid and (R)-2,3-dihydroxy-3-methylbutanoic acid .For acids having an n-butyl substituent at C-3, the activities were close to zero. (2RS,3SR)-2,3-Dihydroxybutanoic acid (threo isomer) underwent dehydration at a rate comparable with that of (2R,3R)-DHI, the natural substrate in the isoleucine pathway, whereas the (2RS,3RS)-acid (erythro-isomer) had much lower activity and (RS)-glyceric acid had even less activity.These results illustrate differences in the alkyl group requirements with respect to the areas of the binding site of the enzyme that accomodate the C-3 substituents.They also demonstrate the size limits of the alkyl groups that can be accomodated in substrate analogues.

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