Home Other Building Blocks 4(1H)-Cinnolinone, 1-methyl-

4(1H)-Cinnolinone, 1-methyl-

CAS No.:
1556-22-5
Catalog Number:
AG001O1M
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
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Product Description
Catalog Number:
AG001O1M
Chemical Name:
4(1H)-Cinnolinone, 1-methyl-
CAS Number:
1556-22-5
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
MDL Number:
MFCD22054727
IUPAC Name:
1-methylcinnolin-4-one
InChI:
InChI=1S/C9H8N2O/c1-11-8-5-3-2-4-7(8)9(12)6-10-11/h2-6H,1H3
InChI Key:
FCXKVIORKAJMPI-UHFFFAOYSA-N
SMILES:
Cn1ncc(=O)c2c1cccc2
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.064g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties