Benzoic acid, 2,5-dimethyl-4-nitro-


Chemical Name: Benzoic acid, 2,5-dimethyl-4-nitro-
CAS Number: 6954-70-7
Product Number: AG0036LJ(AGN-PC-0JOL5I)
Synonyms:
MDL No:
Molecular Formula: C9H9NO4
Molecular Weight: 195.1721

Identification/Properties


Properties
BP:
367.2°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
195.174g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
195.053g/mol
Monoisotopic Mass:
195.053g/mol
Topological Polar Surface Area:
83.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
248
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


NMR Spectrum


Other Analytical Data


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