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478628

Sigma-Aldrich

4-Bromo-2,6-dimethylphenyl isocyanate

98%

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About This Item

Linear Formula:
BrC6H2(CH3)2NCO
CAS Number:
77159-76-3
Molecular Weight:
226.07
MDL number:
MFCD00037040
UNSPSC Code:
12352100
PubChem Substance ID:
24871531

Assay

98%

mp

62-64 °C (lit.)

storage temp.

2-8°C

SMILES string

Cc1cc(Br)cc(C)c1N=C=O

InChI

1S/C9H8BrNO/c1-6-3-8(10)4-7(2)9(6)11-5-12/h3-4H,1-2H3

InChI key

XGBDVSJAHTYSBK-UHFFFAOYSA-N

General description

4-Bromo-2,6-dimethylphenyl isocyanate, also known as 5-bromo-2-isocyanato-1,3-dimethylbenzene, is an aryl isocyanate.

Pictograms

Health hazardExclamation mark
GHS08,GHS07

Signal Word

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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