Home Carboxys 3,4-dimethylcinnoline-6-carboxylic acid

3,4-dimethylcinnoline-6-carboxylic acid

CAS No.:
1176775-00-0
Catalog Number:
AG01DV17
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
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Product Description
Catalog Number:
AG01DV17
Chemical Name:
3,4-dimethylcinnoline-6-carboxylic acid
CAS Number:
1176775-00-0
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD11902150
IUPAC Name:
3,4-dimethylcinnoline-6-carboxylic acid
InChI:
InChI=1S/C11H10N2O2/c1-6-7(2)12-13-10-4-3-8(11(14)15)5-9(6)10/h3-5H,1-2H3,(H,14,15)
InChI Key:
NZLXMIDRIKRNOV-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)c(C)c(nn2)C
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties