Benzoic acid, 2-chloro-3,5-dinitro-


Chemical Name: Benzoic acid, 2-chloro-3,5-dinitro-
CAS Number: 2497-91-8
Product Number: AG002Q19(AGN-PC-0JKDCS)
Synonyms:
MDL No:
Molecular Formula: C7H3ClN2O6
Molecular Weight: 246.5615

Identification/Properties


Properties
MP:
196-199°C
BP:
240-241°C
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
1.6660 (estimate)
Computed Properties
Molecular Weight:
246.559g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
245.968g/mol
Monoisotopic Mass:
245.968g/mol
Topological Polar Surface Area:
129A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
324
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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