Home Carboxys 2-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxylic acid

2-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxylic acid

CAS No.:
773057-18-4
Catalog Number:
AG01E9RS
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
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Product Description
Catalog Number:
AG01E9RS
Chemical Name:
2-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxylic acid
CAS Number:
773057-18-4
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
MDL Number:
MFCD09815064
IUPAC Name:
2-methyl-4-oxo-4aH-quinazoline-7-carboxylic acid
InChI:
InChI=1S/C10H8N2O3/c1-5-11-8-4-6(10(14)15)2-3-7(8)9(13)12-5/h2-4,7H,1H3,(H,14,15)
InChI Key:
MSHUZBQLPUASSR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)nc([nH]c2=O)C
Properties
Complexity:
469  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.185g/mol
Monoisotopic Mass:
204.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
79.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties