Benzoic acid, 2-methyl-6-nitro-, anhydride


Chemical Name: Benzoic acid, 2-methyl-6-nitro-, anhydride
CAS Number: 434935-69-0
Product Number: AG003HO3(AGN-PC-0N50QM)
Synonyms:
MDL No:
Molecular Formula: C16H12N2O7
Molecular Weight: 344.2757

Identification/Properties


Properties
MP:
177 °C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
344.279g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
4
Exact Mass:
344.064g/mol
Monoisotopic Mass:
344.064g/mol
Topological Polar Surface Area:
135A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
506
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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