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78478-61-2,MFCD29059279
Catalog No.:AA00IL41

78478-61-2 | Methyl 5-oxobicyclo[2.2.2]octane-2-carboxylate

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100mg
92%
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$397.00   $278.00
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Technical Information
Catalog Number:
AA00IL41
Chemical Name:
Methyl 5-oxobicyclo[2.2.2]octane-2-carboxylate
CAS Number:
78478-61-2
Molecular Formula:
C10H14O3
Molecular Weight:
182.2164
MDL Number:
MFCD29059279
SMILES:
COC(=O)C1CC2CCC1CC2=O
Properties
Computed Properties
 
Complexity:
247  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
3  
XLogP3:
0.9  

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SDS
Tags:78478-61-2 Molecular Formula|78478-61-2 MDL|78478-61-2 SMILES|78478-61-2 Methyl 5-oxobicyclo[2.2.2]octane-2-carboxylate