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Merck
CN

251844

2-Bromophenyl isocyanate

97%

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About This Item

Linear Formula:
BrC6H4NCO
CAS Number:
Molecular Weight:
198.02
UNSPSC Code:
12352100
PubChem Substance ID:
MDL number:
Assay:
97%
Form:
liquid
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assay

97%

form

liquid

refractive index

n20/D 1.5838 (lit.)

bp

56-58 °C/0.05 mmHg (lit.)

density

1.607 g/mL at 25 °C (lit.)

SMILES string

Brc1ccccc1N=C=O

InChI

1S/C7H4BrNO/c8-6-3-1-2-4-7(6)9-5-10/h1-4H

InChI key

GOOVAYJIVMBWPP-UHFFFAOYSA-N

Application

2-Bromophenyl isocyanate has been used in the synthesis of:
  • α-cyclodextrin-based size-complementary [3] rotaxane with an alkylene axle
  • dihydroindole urea derivatives
  • 3-carboxamide substituted diphenylurea


pictograms

Skull and crossbonesHealth hazard

signalword

Danger

Hazard Classifications

Acute Tox. 3 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

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

226.4 °F - closed cup

flash_point_c

108 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter



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