[1,3]Dioxolo[4,5-g]cinnoline-3-carboxylic acid,1-ethyl-1,4-dihydro-4-oxo-


Chemical Name: [1,3]Dioxolo[4,5-g]cinnoline-3-carboxylic acid,1-ethyl-1,4-dihydro-4-oxo-
CAS Number: 28657-80-9
Product Number: AG002W0O(AGN-PC-0R4BDL)
Synonyms:
MDL No:
Molecular Formula: C12H10N2O5
Molecular Weight: 262.2182

Identification/Properties


Properties
MP:
261-262° (dec)
BP:
517.2°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Refractive Index:
1.6660 (estimate)
Solubility:
1 M NaOH: soluble50mg/mL
Computed Properties
Molecular Weight:
262.221g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
2
Exact Mass:
262.059g/mol
Monoisotopic Mass:
262.059g/mol
Topological Polar Surface Area:
88.4A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
449
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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