CAS 40817-08-1 4'-Pentyl-4-biphenylcarbonitrile

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4'-Pentyl-4-biphenylcarbonitrile

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Catalog Number

ACM40817081-2

CAS Number

40817-08-1

Product Name

4'-Pentyl-4-biphenylcarbonitrile

Structure

Category

Liquid Crystal (LC) Materials

IUPAC Name

4-(4-pentylphenyl)benzonitrile

Molecular Weight

249.3g/mol

Molecular Formula

C18H19N

Canonical SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H19N/c1-2-3-4-5-15-6-10-17(11-7-15)18-12-8-16(14-19)9-13-18/h6-13H,2-5H2,1H3

InChI Key

HHPCNRKYVYWYAU-UHFFFAOYSA-N

Complexity

284

Covalently-Bonded Unit Count

EC Number

255-093-2

Exact Mass

249.15175g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

4-cyano-4'-pentylbiphenyl;4-n-pentyl-4'-cyanobiphenyl

Monoisotopic Mass

249.15175g/mol

Rotatable Bond Count

XLogP3

5.4

MSDS

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COA

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Spec Sheet

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