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AB74860

589-59-3 | Isobutyl isovalerate

Packsize Purity Availability Price Discounted Price    Quantity
5g 97% in stock $25.00 $17.00 -   +
25g 97% in stock $28.00 $19.00 -   +
100g 97% in stock $65.00 $45.00 -   +
500g 97% in stock $249.00 $175.00 -   +

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Description
Catalog Number: AB74860
Chemical Name: Isobutyl isovalerate
CAS Number: 589-59-3
Molecular Formula: C9H18O2
Molecular Weight: 158.238
MDL Number: MFCD00048349
SMILES: CC(COC(=O)CC(C)C)C
NSC Number: 6993

 

Computed Properties
Complexity: 117  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 2  
Rotatable Bond Count: 5  
Undefined Atom Stereocenter Count: 1  
XLogP3: 2.7  

 

 

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