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Home Fluorides 122549-26-2
122549-26-2,MFCD07369217
Catalog No.:AA0017DJ

122549-26-2 | Pentanoic acid, 2-[(4-fluorophenyl)methylene]-4-methyl-3-oxo-, methyl ester

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Technical Information
Catalog Number:
AA0017DJ
Chemical Name:
Pentanoic acid, 2-[(4-fluorophenyl)methylene]-4-methyl-3-oxo-, methyl ester
CAS Number:
122549-26-2
Molecular Formula:
C14H15FO3
Molecular Weight:
250.2655
MDL Number:
MFCD07369217
SMILES:
COC(=O)C(=Cc1ccc(cc1)F)C(=O)C(C)C
Properties
Computed Properties
 
Complexity:
339  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
5  
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.2  

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SDS
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Tags:122549-26-2 Molecular Formula|122549-26-2 MDL|122549-26-2 SMILES|122549-26-2 Pentanoic acid, 2-[(4-fluorophenyl)methylene]-4-methyl-3-oxo-, methyl ester