3(4H)-Quinazolineacetic acid, 4-oxo-


Chemical Name: 3(4H)-Quinazolineacetic acid, 4-oxo-
CAS Number: 14663-53-7
Product Number: AG007J2Z(AGN-PC-0JVKC3)
Synonyms:
MDL No:
Molecular Formula: C10H8N2O3
Molecular Weight: 204.1821

Identification/Properties


Computed Properties
Molecular Weight:
204.185g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
204.053g/mol
Monoisotopic Mass:
204.053g/mol
Topological Polar Surface Area:
70A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
314
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:
H315-H319-H335
Precautionary Statements:
P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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