Benzonitrile, 4-(trans-4-pentylcyclohexyl)-


Chemical Name: Benzonitrile, 4-(trans-4-pentylcyclohexyl)-
CAS Number: 61204-01-1
Product Number: AG003UXK(AGN-PC-0ODANI)
Synonyms:
MDL No: MFCD00075548
Molecular Formula: C18H25N
Molecular Weight: 255.3978

Identification/Properties


Properties
MP:
30-55 °C(lit.);
BP:
381°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
255.405g/mol
XLogP3:
6.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
5
Exact Mass:
255.199g/mol
Monoisotopic Mass:
255.199g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
284
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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