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About This Item
Linear Formula:
BrC6H4NCO
CAS Number:
Molecular Weight:
198.02
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
219-662-9
MDL number:
Assay:
99%
Quality Segment
assay
99%
bp
158 °C/14 mmHg (lit.)
mp
42-44 °C (lit.)
solubility
diethyl ether: very slightly soluble
functional group
bromo, isocyanate
SMILES string
Brc1ccc(cc1)N=C=O
InChI
1S/C7H4BrNO/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChI key
CZQIJQFTRGDODI-UHFFFAOYSA-N
Application
4-Bromophenyl isocyanate was used in the synthesis of mixed bisamide derivative and monoamide product.
signalword
Danger
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
228.2 °F - closed cup
flash_point_c
109 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves
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