CAS 64409-12-7 4'-Mercaptobiphenylcarbonitrile

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4'-Mercaptobiphenylcarbonitrile

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Catalog Number

ACM64409127

CAS Number

64409-12-7

Product Name

4'-Mercaptobiphenylcarbonitrile

Category

Self-Assembly Materials

IUPAC Name

4-(4-sulfanylphenyl)benzonitrile

Molecular Weight

211.28g/mol

Molecular Formula

C13H9NS

Canonical SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)S

InChI

InChI=1S/C13H9NS/c14-9-10-1-3-11(4-2-10)12-5-7-13(15)8-6-12/h1-8,15H

InChI Key

ZZSHJNKMDIZSFY-UHFFFAOYSA-N

Complexity

239

Covalently-Bonded Unit Count

Exact Mass

211.04557g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

211.04557g/mol

Rotatable Bond Count

XLogP3

4.2

MSDS

COA

Spec Sheet

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