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88636-41-3,MFCD00464539
Catalog No.:AA01AF8L

88636-41-3 | 5-(4-methylphenyl)-5-oxopentanenitrile

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Technical Information
Catalog Number:
AA01AF8L
Chemical Name:
5-(4-methylphenyl)-5-oxopentanenitrile
CAS Number:
88636-41-3
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD00464539
SMILES:
N#CCCCC(=O)c1ccc(cc1)C
Properties
Computed Properties
 
Complexity:
230  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
2  

Literature
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Additional Info:
SDS
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Tags:88636-41-3 Molecular Formula|88636-41-3 MDL|88636-41-3 SMILES|88636-41-3 5-(4-methylphenyl)-5-oxopentanenitrile