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


Chemical Name: [1,1'-Biphenyl]-4-carbonitrile, 4'-(octyloxy)-
CAS Number: 52364-73-5
Product Number: AG00D8AK(AGN-PC-0JLE6I)
Synonyms:
MDL No:
Molecular Formula: C21H25NO
Molecular Weight: 307.4293

Identification/Properties


Computed Properties
Molecular Weight:
307.437g/mol
XLogP3:
6.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
9
Exact Mass:
307.194g/mol
Monoisotopic Mass:
307.194g/mol
Topological Polar Surface Area:
33A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
342
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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