4-amino-3-chloro-5-fluorobenzonitrile


Chemical Name: 4-amino-3-chloro-5-fluorobenzonitrile
CAS Number: 1147558-43-7
Product Number: AG000F5X(AGN-PC-0HQ4B0)
Synonyms:
MDL No:
Molecular Formula: C7H4ClFN2
Molecular Weight: 170.5715

Identification/Properties


Computed Properties
Molecular Weight:
170.571g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
170.005g/mol
Monoisotopic Mass:
170.005g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
188
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

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NMR Spectrum


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