2,6-dichloro-4-cyanobenzoicacid


Chemical Name: 2,6-dichloro-4-cyanobenzoicacid
CAS Number: 1258298-05-3
Product Number: AG000OSP(AGN-PC-0WAJQJ)
Synonyms:
MDL No:
Molecular Formula: C8H3Cl2NO2
Molecular Weight: 216.0209

Identification/Properties


Computed Properties
Molecular Weight:
216.017g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
214.954g/mol
Monoisotopic Mass:
214.954g/mol
Topological Polar Surface Area:
61.1A^2
Heavy Atom Count:
13
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


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