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87775-67-5

87775-67-5 | 4-(2-methyl-2-phenyl-hydrazinyl)-3H-pyrimidin-2-one

CAS No: 87775-67-5 Catalog No: AG004IBN MDL No:

Product Description

Catalog Number:
AG004IBN
Chemical Name:
4-(2-methyl-2-phenyl-hydrazinyl)-3H-pyrimidin-2-one
CAS Number:
87775-67-5
Molecular Formula:
C11H12N4O
Molecular Weight:
216.2392
IUPAC Name:
6-(2-methyl-2-phenylhydrazinyl)-1H-pyrimidin-2-one
InChI:
InChI=1S/C11H12N4O/c1-15(9-5-3-2-4-6-9)14-10-7-8-12-11(16)13-10/h2-8H,1H3,(H2,12,13,14,16)
InChI Key:
IFUTYRDCYGGIHA-UHFFFAOYSA-N
SMILES:
O=c1nccc([nH]1)NN(c1ccccc1)C
NSC Number:
381253

Properties

Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.101g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.244g/mol
Monoisotopic Mass:
216.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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