2-Quinazolinecarboxylic acid, 1,4-dihydro-4-oxo-, ethyl ester


Chemical Name: 2-Quinazolinecarboxylic acid, 1,4-dihydro-4-oxo-, ethyl ester
CAS Number: 29113-33-5
Product Number: AG002XDC(AGN-PC-0JPD8Z)
Synonyms:
MDL No:
Molecular Formula: C11H10N2O3
Molecular Weight: 218.2087

Identification/Properties


Computed Properties
Molecular Weight:
218.212g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
218.069g/mol
Monoisotopic Mass:
218.069g/mol
Topological Polar Surface Area:
67.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
338
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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