Benzoic acid, 3,4-dichloro-


Chemical Name: Benzoic acid, 3,4-dichloro-
CAS Number: 51-44-5
Product Number: AG003IG2(AGN-PC-0JK7DW)
Synonyms:
MDL No:
Molecular Formula: C7H4Cl2O2
Molecular Weight: 191.0115

Identification/Properties


Properties
MP:
204-206 °C(lit.)
BP:
317.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4590 (estimate)
Computed Properties
Molecular Weight:
191.007g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
189.959g/mol
Monoisotopic Mass:
189.959g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
161
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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