Home Carboxys 3-methyl-2-oxo-1,2,3,4-tetrahydroquinazoline-6-carboxylic acid

3-methyl-2-oxo-1,2,3,4-tetrahydroquinazoline-6-carboxylic acid

CAS No.:
118621-07-1
Catalog Number:
AG01B9WK
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
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Product Description
Catalog Number:
AG01B9WK
Chemical Name:
3-methyl-2-oxo-1,2,3,4-tetrahydroquinazoline-6-carboxylic acid
CAS Number:
118621-07-1
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD23715563
IUPAC Name:
3-methyl-2-oxo-1,4-dihydroquinazoline-6-carboxylic acid
InChI:
InChI=1S/C10H10N2O3/c1-12-5-7-4-6(9(13)14)2-3-8(7)11-10(12)15/h2-4H,5H2,1H3,(H,11,15)(H,13,14)
InChI Key:
BMCJSNCJNFZGMR-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccc(cc2CN1C)C(=O)O
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties