86728-85-0,MFCD00211241
Catalog No.:AA003CJR

86728-85-0 | Ethyl (S)-4-chloro-3-hydroxybutyrate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10g
97%
in stock  
$7.00   $5.00
- +
25g
97%
in stock  
$11.00   $8.00
- +
100g
97%
in stock  
$20.00   $14.00
- +
500g
~85%(GC)
in stock  
$32.00   $23.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003CJR
Chemical Name:
Ethyl (S)-4-chloro-3-hydroxybutyrate
CAS Number:
86728-85-0
Molecular Formula:
C6H11ClO3
Molecular Weight:
166.6027
MDL Number:
MFCD00211241
SMILES:
CCOC(=O)C[C@@H](CCl)O
Properties
Properties
 
BP:
93-95°C at 5 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.453(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
105  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.4  

Synonyms
 
728E850  
Literature

Title: Asymmetric synthesis of (S)-ethyl-4-chloro-3-hydroxy butanoate using a Saccharomyces cerevisiae reductase: enantioselectivity and enzyme-substrate docking studies.

Journal: Biochimica et biophysica acta 20100901

Title: Asymmetric synthesis of (S)-ethyl-4-chloro-3-hydroxybutanoate using Candida parapsilosis ATCC 7330.

Journal: Journal of industrial microbiology & biotechnology 20100201

Title: Improvement of natural isolates of Saccharomyces cerevisiae strains for synthesis of a chiral building block using classic genetics.

Journal: Applied microbiology and biotechnology 20080301

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SDS
Tags:86728-85-0 Molecular Formula|86728-85-0 MDL|86728-85-0 SMILES|86728-85-0 Ethyl (S)-4-chloro-3-hydroxybutyrate
Catalog No.: AA003CJR
86728-85-0,MFCD00211241
86728-85-0 | Ethyl (S)-4-chloro-3-hydroxybutyrate
Pack Size: 10g
Purity: 97%
in stock
$7.00 $5.00
Pack Size: 25g
Purity: 97%
in stock
$11.00 $8.00
Pack Size: 100g
Purity: 97%
in stock
$20.00 $14.00
Pack Size: 500g
Purity: ~85%(GC)
in stock
$32.00 $23.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003CJR
Chemical Name: Ethyl (S)-4-chloro-3-hydroxybutyrate
CAS Number: 86728-85-0
Molecular Formula: C6H11ClO3
Molecular Weight: 166.6027
MDL Number: MFCD00211241
SMILES: CCOC(=O)C[C@@H](CCl)O
Properties
BP: 93-95°C at 5 mmHg  
Form: Liquid  
Refractive Index: n20/D 1.453(lit.)  
Storage: Keep in dry area;Room Temperature;  
Complexity: 105  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 1  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 5  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.4  
52: 728E850  
Literature fold

Title: Asymmetric synthesis of (S)-ethyl-4-chloro-3-hydroxy butanoate using a Saccharomyces cerevisiae reductase: enantioselectivity and enzyme-substrate docking studies.

Journal: Biochimica et biophysica acta20100901

Title: Asymmetric synthesis of (S)-ethyl-4-chloro-3-hydroxybutanoate using Candida parapsilosis ATCC 7330.

Journal: Journal of industrial microbiology & biotechnology20100201

Title: Improvement of natural isolates of Saccharomyces cerevisiae strains for synthesis of a chiral building block using classic genetics.

Journal: Applied microbiology and biotechnology20080301

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