2H-1-Benzopyran-2-one, 6-nitro-


Chemical Name: 2H-1-Benzopyran-2-one, 6-nitro-
CAS Number: 2725-81-7
Product Number: AG003NB8(AGN-PC-0JLPOX)
Synonyms:
MDL No:
Molecular Formula: C9H5NO4
Molecular Weight: 191.1403

Identification/Properties


Properties
MP:
186 °C
BP:
394.3°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.4500 (estimate)
Computed Properties
Molecular Weight:
191.142g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
191.022g/mol
Monoisotopic Mass:
191.022g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
294
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#:
N/A
Hazard Statements:
H302-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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