Benzonitrile, 2-amino-3,5-difluoro-


Chemical Name: Benzonitrile, 2-amino-3,5-difluoro-
CAS Number: 126674-94-0
Product Number: AG000T33(AGN-PC-0029LQ)
Synonyms:
MDL No:
Molecular Formula: C7H4F2N2
Molecular Weight: 154.1169

Identification/Properties


Computed Properties
Molecular Weight:
154.12g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
154.034g/mol
Monoisotopic Mass:
154.034g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
186
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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