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56187-93-0,MFCD09841174
Catalog No.:AA00DF9J

56187-93-0 | 4-(Phenyl-D5)-3-buten-2-one

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Technical Information
Catalog Number:
AA00DF9J
Chemical Name:
4-(Phenyl-D5)-3-buten-2-one
CAS Number:
56187-93-0
Molecular Formula:
C10H5D5O
Molecular Weight:
151.2166
MDL Number:
MFCD09841174
SMILES:
c1([2H])c(/C=C/C(=O)C)c([2H])c(c(c1[2H])[2H])[2H]
Properties
Properties
 
Storage:
2-8℃;  

Computed Properties
 
Complexity:
152  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Isotope Atom Count:
5  
Rotatable Bond Count:
2  
XLogP3:
2.1  

Literature
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Additional Info:
SDS
Tags:56187-93-0 Molecular Formula|56187-93-0 MDL|56187-93-0 SMILES|56187-93-0 4-(Phenyl-D5)-3-buten-2-one