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1246817-13-9
Catalog No.:AA00A1PV

1246817-13-9 | 4-Acetylbutyric Acid-d5

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Technical Information
Catalog Number:
AA00A1PV
Chemical Name:
4-Acetylbutyric Acid-d5
CAS Number:
1246817-13-9
Molecular Formula:
C6H5D5O3
Molecular Weight:
135.1726
SMILES:
OC(=O)CCC(C(=O)C([2H])([2H])[2H])([2H])[2H]
Properties
Computed Properties
 
Complexity:
118  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
5  
Rotatable Bond Count:
4  
XLogP3:
-0.3  

Literature
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Additional Info:
SDS
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Tags:1246817-13-9 Molecular Formula|1246817-13-9 MDL|1246817-13-9 SMILES|1246817-13-9 4-Acetylbutyric Acid-d5