3-Chloro-2-fluorobenzonitrile


Chemical Name: 3-Chloro-2-fluorobenzonitrile
CAS Number: 94087-40-8
Product Number: AG003J6U(AGN-PC-0WA8ET)
Synonyms:
MDL No:
Molecular Formula: C7H3ClFN
Molecular Weight: 155.5568

Identification/Properties


Properties
MP:
40-44 °C(lit.)
BP:
206.3 °C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
155.556g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
154.994g/mol
Monoisotopic Mass:
154.994g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
162
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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