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52364-73-5

52364-73-5 structural image
Product Name: 4'-(Octyloxy)-4-biphenylcarbonitrile
Formula: C21H25NO
Synonyms: 4′-(Octyloxy)-4-biphenylcarbonitrile;4′-(Octyloxy)-4-cyanobiphenyl;4′-Octyloxy-1,1′-biphenyl-4-carbonitrile;4-(4-Octyloxyphenyl)benzonitrile;4-(Octyloxy)-4′-cyanobiphenyl
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H413:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 307.4 g/mol
XLogP3 6.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 9
Exact Mass 307.193614421 g/mol
Monoisotopic Mass 307.193614421 g/mol
Topological Polar Surface Area 33 Ų
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