[1,1'-Biphenyl]-4-carbonitrile, 4'-(heptyloxy)-


Chemical Name: [1,1'-Biphenyl]-4-carbonitrile, 4'-(heptyloxy)-
CAS Number: 52364-72-4
Product Number: AG003LGS(AGN-PC-0JLE6H)
Synonyms:
MDL No:
Molecular Formula: C20H23NO
Molecular Weight: 293.4027

Identification/Properties


Properties
MP:
54-57 °C(lit.)
BP:
442.9°C at 760 mmHg
Storage:
Room Temperature;
Form:
Liquid
Computed Properties
Molecular Weight:
293.41g/mol
XLogP3:
6.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
8
Exact Mass:
293.178g/mol
Monoisotopic Mass:
293.178g/mol
Topological Polar Surface Area:
33A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
329
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:
H312-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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