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About This Item
Linear Formula:
IC6H4NO2
CAS Number:
Molecular Weight:
249.01
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Quality Level
Assay
99%
form
solid
bp
280 °C (lit.)
mp
36-38 °C (lit.)
functional group
iodo
nitro
SMILES string
[O-][N+](=O)c1cccc(I)c1
InChI
1S/C6H4INO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H
InChI key
CBYAZOKPJYBCHE-UHFFFAOYSA-N
Application
1-Iodo-3-nitrobenzene was used in the synthesis of 5-substituted pyrrolo[3,2-b]pyridine amide and 3′-nitro-4-methylthiobiphenyl. It was used in palladium(0) catalyzed cross-coupling reaction between heteroarylzinc iodide and unsaturated iodide.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Sol. 1 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
4.1B - Flammable solid hazardous materials
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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