Benzonitrile, 4-(trans-4-propylcyclohexyl)-


Chemical Name: Benzonitrile, 4-(trans-4-propylcyclohexyl)-
CAS Number: 61203-99-4
Product Number: AG003E91(AGN-PC-0ODANE)
Synonyms:
MDL No: MFCD04038799
Molecular Formula: C16H21N
Molecular Weight: 227.3446

Identification/Properties


Properties
MP:
45°C
BP:
351.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
227.351g/mol
XLogP3:
5.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
3
Exact Mass:
227.167g/mol
Monoisotopic Mass:
227.167g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
259
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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