Benzonitrile, 4-(trans-4-ethylcyclohexyl)-


Chemical Name: Benzonitrile, 4-(trans-4-ethylcyclohexyl)-
CAS Number: 72928-54-2
Product Number: AG003E90(AGN-PC-0OH7BB)
Synonyms:
MDL No:
Molecular Formula: C15H19N
Molecular Weight: 213.3181

Identification/Properties


Properties
MP:
39-41°C
BP:
336.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
213.324g/mol
XLogP3:
5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
213.152g/mol
Monoisotopic Mass:
213.152g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
246
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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