Benzeneacetonitrile,3,5-bis(1,1-dimethylethyl)-4-hydroxy-

CAS
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CAS
1611-07-0
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Purity
96%
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Catalog Number

ACM1611070

Product Name

Benzeneacetonitrile,3,5-bis(1,1-dimethylethyl)-4-hydroxy-

Structure

CAS

1611-07-0

Category

Heterocyclic Organic Compound

Synonyms

ZINC00157305, BTB09886, CID615568, (3,5-Ditert-butyl-4-hydroxyphenyl)acetonitrile, 2,6-Bis(1,1-dimethylethyl)-4-cyanomethylphenol, 1611-07-0

IUPAC Name

2-(3,5-ditert-butyl-4-hydroxyphenyl)acetonitrile

Molecular Weight

245.36

Molecular Formula

C₁₆H₂₃NO

Canonical SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC#N

InChI Key

BEQZSRGZHCDMMH-UHFFFAOYSA-N

Boiling Point

323ºC at 760 mmHg

Melting Point

104ºC

Flash Point

149.2ºC

Density

0.991 g/cm³

Appearance

Colourless to light yellow crystalline solid

Exact Mass

245.17800

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

H-Bond Donor

Packing Group

III

Safety Description

22-36/37/39-45

MSDS

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COA

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Spec Sheet

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