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About This Item
Linear Formula:
BrC6H4CN
CAS Number:
Molecular Weight:
182.02
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
230-127-9
MDL number:
Product Name
3-Bromobenzonitrile, 99%
InChI key
STXAVEHFKAXGOX-UHFFFAOYSA-N
InChI
1S/C7H4BrN/c8-7-3-1-2-6(4-7)5-9/h1-4H
SMILES string
Brc1cccc(c1)C#N
assay
99%
form
powder
bp
225 °C (lit.)
mp
38-40 °C (lit.)
Quality Level
Related Categories
signalword
Warning
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
13 - Non Combustible Solids
wgk
WGK 3
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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