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53409-18-0,MFCD00102304
Catalog No.:AA01EWAT

53409-18-0 | 1,2-Dihydro-4-methyl-1-(phenylmethyl)-3H-pyrazol-3-one

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Technical Information
Catalog Number:
AA01EWAT
Chemical Name:
1,2-Dihydro-4-methyl-1-(phenylmethyl)-3H-pyrazol-3-one
CAS Number:
53409-18-0
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
MDL Number:
MFCD00102304
SMILES:
Cc1cn(nc1O)Cc1ccccc1
Properties
Computed Properties
 
Complexity:
254  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.7  

Literature
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SDS
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Tags:53409-18-0 Molecular Formula|53409-18-0 MDL|53409-18-0 SMILES|53409-18-0 1,2-Dihydro-4-methyl-1-(phenylmethyl)-3H-pyrazol-3-one