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Home Other Building Blocks 181289-16-7
181289-16-7,MFCD20645910
Catalog No.:AA00ADTY

181289-16-7 | 3-Cyano-5-methylhexanoic Acid

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Purity
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Price(USD)
Quantity
  
1g
98%
2 weeks  
$760.00   $532.00
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Technical Information
Catalog Number:
AA00ADTY
Chemical Name:
3-Cyano-5-methylhexanoic Acid
CAS Number:
181289-16-7
Molecular Formula:
C8H13NO2
Molecular Weight:
155.1943
MDL Number:
MFCD20645910
SMILES:
N#CC(CC(=O)O)CC(C)C
Properties
Computed Properties
 
Complexity:
178  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.1  

Literature

Title: An enantioselective synthesis of (S)-(+)-3-aminomethyl-5-methylhexanoic acid via asymmetric hydrogenation.

Journal: The Journal of organic chemistry 20030711

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SDS
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Tags:181289-16-7 Molecular Formula|181289-16-7 MDL|181289-16-7 SMILES|181289-16-7 3-Cyano-5-methylhexanoic Acid