1-[3-(trifluoromethyl)phenyl]cyclobutane-1-carbonitrile


Chemical Name: 1-[3-(trifluoromethyl)phenyl]cyclobutane-1-carbonitrile
CAS Number: 29786-43-4
Product Number: AG00BIWV(AGN-PC-03OUGO)
Synonyms:
MDL No:
Molecular Formula: C12H10F3N
Molecular Weight: 225.2097

Identification/Properties


Computed Properties
Molecular Weight:
225.214g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
225.077g/mol
Monoisotopic Mass:
225.077g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
308
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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