2,6-Dimethylphenyl isocyanate

CAS

28556-81-2

Catalog Number

ACM28556812

Category

Solvents

Molecular Weight

147.18

Molecular Formula

C9H9NO

MSDS COA Spec Sheet

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Specification

Synonyms

2,6-dimethyl-5-bromophenyl isocyanate
Benzene,2-isocyanato-1,3-dimethyl

IUPAC Name

2-isocyanato-1,3-dimethylbenzene

Canonical SMILES

CC1=CC=CC(C)=C1N=C=O

InChI

1S/C9H9NO/c1-7-4-3-5-8(2)9(7)10-6-11/h3-5H,1-2H3

InChI Key

YQLRKXVEALTVCZ-UHFFFAOYSA-N

Boiling Point

87-89 °C (12 mmHg)

Flash Point

86 °C

Density

1.057 g/mL

Application

2,6-Dimethylphenyl isocyanate has been used in the preparation of:
1. derivatized β-cyclodextrins, used as chiral stationary phase in normal-phase liquid chromatography.
2. tris( 2,6-dimethylphenylimido)methylrhenium (VII).
3. 1-(2-isopropylphenyl)-3-(2,6-dimethylphenyl)urea.

Assay

0.99

Color

Clear colorless to yellow

Exact Mass

147.068

Form

Liquid

Hazard Codes

Xn:Harmful;

Hazard Statements

H302 + H312 + H332-H315-H319-H335