CAS 52771-22-9 3-(Trifluoromethoxy)benzonitrile, 98%

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3-(Trifluoromethoxy)benzonitrile, 98%

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Catalog Number

ACM52771229

CAS Number

52771-22-9

Product Name

3-(Trifluoromethoxy)benzonitrile, 98%

Structure

Category

Other Glass and Ceramic Materials

IUPAC Name

3-(trifluoromethoxy)benzonitrile

Molecular Weight

187.12g/mol

Molecular Formula

C8H4F3NO

Canonical SMILES

C1=CC(=CC(=C1)OC(F)(F)F)C#N

InChI

InChI=1S/C8H4F3NO/c9-8(10,11)13-7-3-1-2-6(4-7)5-12/h1-4H

InChI Key

DCZAPXGEZYVQNX-UHFFFAOYSA-N

Complexity

217

Covalently-Bonded Unit Count

Exact Mass

187.024498g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

187.024498g/mol

Rotatable Bond Count

XLogP3

2.6

MSDS

COA

Spec Sheet

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