Benzonitrile, 4-methyl-3-(trifluoromethyl)-


Chemical Name: Benzonitrile, 4-methyl-3-(trifluoromethyl)-
CAS Number: 261952-06-1
Product Number: AG002S7B(AGN-PC-0KKWYT)
Synonyms:
MDL No:
Molecular Formula: C9H6F3N
Molecular Weight: 185.1458

Identification/Properties


Properties
MP:
60-62°C
BP:
220°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
185.149g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
185.045g/mol
Monoisotopic Mass:
185.045g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
225
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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