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887978-52-1,MFCD06410572
Catalog No.:AA00GYFQ

887978-52-1 | 1-(4-Methylphenyl)-4-oxocyclohexanecarboxylic acid

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Technical Information
Catalog Number:
AA00GYFQ
Chemical Name:
1-(4-Methylphenyl)-4-oxocyclohexanecarboxylic acid
CAS Number:
887978-52-1
Molecular Formula:
C14H16O3
Molecular Weight:
232.2750
MDL Number:
MFCD06410572
SMILES:
OC(=O)C1(CCC(=O)CC1)c1ccc(cc1)C
Properties
Computed Properties
 
Complexity:
303  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.8  

Literature
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Additional Info:
SDS
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Tags:887978-52-1 Molecular Formula|887978-52-1 MDL|887978-52-1 SMILES|887978-52-1 1-(4-Methylphenyl)-4-oxocyclohexanecarboxylic acid