CAS 52709-87-2 4-Butoxyl-[1,1'-biphenyl]-4'-carbonitrile

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4-Butoxyl-[1,1'-biphenyl]-4'-carbonitrile

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Catalog Number

ACM52709872-1

CAS Number

52709-87-2

Product Name

4-Butoxyl-[1,1'-biphenyl]-4'-carbonitrile

Structure

Category

Liquid Crystal (LC) Materials

IUPAC Name

4-(4-butoxyphenyl)benzonitrile

Molecular Weight

251.32g/mol

Molecular Formula

C17H17NO

Canonical SMILES

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H17NO/c1-2-3-12-19-17-10-8-16(9-11-17)15-6-4-14(13-18)5-7-15/h4-11H,2-3,12H2,1H3

InChI Key

KPQVQWUNELODQE-UHFFFAOYSA-N

Complexity

290

Covalently-Bonded Unit Count

EC Number

258-123-2

Exact Mass

251.131014g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

251.131014g/mol

Rotatable Bond Count

XLogP3

4.5

MSDS

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COA

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Spec Sheet

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