Home Halogens Ethyl 4-chloro-3-hydroxybutanoate

Ethyl 4-chloro-3-hydroxybutanoate

CAS No.:
10488-69-4
Catalog Number:
AG00381F
Molecular Formula:
C6H11ClO3
Molecular Weight:
166.6027
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$239
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Product Description
Catalog Number:
AG00381F
Chemical Name:
Ethyl 4-chloro-3-hydroxybutanoate
CAS Number:
10488-69-4
Molecular Formula:
C6H11ClO3
Molecular Weight:
166.6027
MDL Number:
MFCD09839767
IUPAC Name:
ethyl 4-chloro-3-hydroxybutanoate
InChI:
InChI=1S/C6H11ClO3/c1-2-10-6(9)3-5(8)4-7/h5,8H,2-4H2,1H3
InChI Key:
ZAJNMXDBJKCCAT-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(CCl)O
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.04g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.601g/mol
Monoisotopic Mass:
166.04g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Literature
Title Journal
Development of a substrate-coupled biocatalytic process driven by an NADPH-dependent sorbose reductase from Candida albicans for the asymmetric reduction of ethyl 4-chloro-3-oxobutanoate. Biotechnology letters 20121201
Effect of ribose, xylose, aspartic acid, glutamine and nicotinic acid on ethyl (S)-4-chloro-3-hydroxybutanoate synthesis by recombinant Escherichia coli. Bioresource technology 20120801
Expression, purification, crystallization and preliminary X-ray analysis of carbonyl reductase S1 from Candida magnoliae. Acta crystallographica. Section F, Structural biology and crystallization communications 20120501
A novel reductase from Candida albicans for the production of ethyl (S)-4-chloro-3-hydroxybutanoate. Bioscience, biotechnology, and biochemistry 20120101
Highly stereoselective reduction of prochiral ketones by a bacterial reductase coupled with cofactor regeneration. Organic & biomolecular chemistry 20110807
Highly efficient synthesis of chiral alcohols with a novel NADH-dependent reductase from Streptomyces coelicolor. Bioresource technology 20110701
A review-biosynthesis of optically pure ethyl (S)-4-chloro-3-hydroxybutanoate ester: recent advances and future perspectives. Applied microbiology and biotechnology 20110201
Purification and characterization of a novel NADH-dependent carbonyl reductase from Pichia stipitis involved in biosynthesis of optically pure ethyl (S)-4-chloro-3-hydroxybutanoate. Bioresource technology 20110101
Biocatalytic synthesis of (S)-4-chloro-3-hydroxybutanoate ethyl ester using a recombinant whole-cell catalyst. Applied microbiology and biotechnology 20101201
Biosynthesis of (S)-4-chloro-3-hydroxybutanoate ethyl using Escherichia coli co-expressing a novel NADH-dependent carbonyl reductase and a glucose dehydrogenase. Bioresource technology 20101101
Construction and co-expression of a polycistronic plasmid encoding carbonyl reductase and glucose dehydrogenase for production of ethyl (S)-4-chloro-3-hydroxybutanoate. Bioresource technology 20100901
Asymmetric synthesis of (S)-ethyl-4-chloro-3-hydroxy butanoate using a Saccharomyces cerevisiae reductase: enantioselectivity and enzyme-substrate docking studies. Biochimica et biophysica acta 20100901
Enantioselective bioconversion using Escherichia coli cells expressing Saccharomyces cerevisiae reductase and Bacillus subtilis glucose dehydrogenase. Journal of microbiology and biotechnology 20100901
High-level production of heterologous proteins using untreated cane molasses and corn steep liquor in Escherichia coli medium. Applied microbiology and biotechnology 20100601
Asymmetric synthesis of (S)-ethyl-4-chloro-3-hydroxybutanoate using Candida parapsilosis ATCC 7330. Journal of industrial microbiology & biotechnology 20100201
A new member of the short-chain dehydrogenases/reductases superfamily: purification, characterization and substrate specificity of a recombinant carbonyl reductase from Pichia stipitis. Bioresource technology 20091201
A novel carbonyl reductase from Pichia stipitis for the production of ethyl (S)-4-chloro-3-hydroxybutanoate. Biotechnology letters 20090401
Improvement of natural isolates of Saccharomyces cerevisiae strains for synthesis of a chiral building block using classic genetics. Applied microbiology and biotechnology 20080301
High-level expression of recombinant glucose dehydrogenase and its application in NADPH regeneration. Journal of industrial microbiology & biotechnology 20070101
Enthalpy change on mixing a couple of S- and R-enantiomers of some chiral compounds at 298.15 K. Chirality 20060801
Construction of a two-strain system for asymmetric reduction of ethyl 4-chloro-3-oxobutanoate to (S)-4-chloro-3-hydroxybutanoate ethyl ester. Applied microbiology and biotechnology 20060301
Robust NADH-regenerator: improved alpha-haloketone-resistant formate dehydrogenase. Applied microbiology and biotechnology 20050401
Asymmetric reduction of ethyl 4-chloro-3-oxobutanoate to ethyl (R)-4-chloro-3-hydroxybutanoate with two co-existing, recombinant Escherichia coli strains. Biotechnology letters 20050101
Efficient production of recombinant aldehyde reductase and its application for asymmetric reduction of ethyl 4-chloro-3-oxobutanoate to ethyl (R)-4-chloro-3-hydroxybutanoate. Preparative biochemistry & biotechnology 20050101
A novel NADH-dependent carbonyl reductase from Kluyveromyces aestuarii and comparison of NADH-regeneration system for the synthesis of ethyl (S)-4-chloro-3-hydroxybutanoate. Bioscience, biotechnology, and biochemistry 20040301
Synthesis of ethyl ( S)-4-chloro-3-hydroxybutanoate using fabG-homologues. Applied microbiology and biotechnology 20030401
Applying the Taguchi robust design to the optimization of the asymmetric reduction of ethyl 4-chloro acetoacetate by bakers' yeast. Journal of biotechnology 20030213
Applying slow-release biocatalysis to the asymmetric reduction of ethyl 4-chloroacetoacetate. Biotechnology letters 20030101
Purification and properties of a carbonyl reductase useful for production of ethyl (S)-4-chloro-3-hydroxybutanoate from Kluyveromyces lactis. Bioscience, biotechnology, and biochemistry 20020801
Synthesis of ethyl (R)-4-chloro-3-hydroxybutanoate with recombinant Escherichia coli cells expressing (S)-specific secondary alcohol dehydrogenase. Bioscience, biotechnology, and biochemistry 20020201
Design of the pH profile for asymmetric bioreduction of ethyl 4-chloro-3-oxobutyrate on the basis of a data-driven method. Biotechnology progress 20020101
Stereoselective reduction of ethyl 4-chloro-3-oxobutanoate by fungi. Bioscience, biotechnology, and biochemistry 20010701
Synthesis of optically pure ethyl (S)-4-chloro-3-hydroxybutanoate by Escherichia coli transformant cells coexpressing the carbonyl reductase and glucose dehydrogenase genes. Applied microbiology and biotechnology 20010501
Properties