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Home Other Building Blocks 7-phenyl-3H,4H,7H-pyrazolo[3,4-d][1,2,3]triazin-4-one

7-phenyl-3H,4H,7H-pyrazolo[3,4-d][1,2,3]triazin-4-one

CAS No.:
114163-48-3
Catalog Number:
AG019YF4
Molecular Formula:
C10H7N5O
Molecular Weight:
213.1955
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Product Description
Catalog Number:
AG019YF4
Chemical Name:
7-phenyl-3H,4H,7H-pyrazolo[3,4-d][1,2,3]triazin-4-one
CAS Number:
114163-48-3
Molecular Formula:
C10H7N5O
Molecular Weight:
213.1955
MDL Number:
MFCD14816390
IUPAC Name:
7-phenyl-3H-pyrazolo[3,4-d]triazin-4-one
InChI:
InChI=1S/C10H7N5O/c16-10-8-6-11-15(9(8)12-14-13-10)7-4-2-1-3-5-7/h1-6H,(H,12,13,16)
InChI Key:
ODBQOGDBWHQVKL-UHFFFAOYSA-N
SMILES:
O=c1[nH]nnc2c1cnn2c1ccccc1
NSC Number:
113988
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.065g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.2g/mol
Monoisotopic Mass:
213.065g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties