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About This Item
Linear Formula:
O2NC6H3(CF3)CN
CAS Number:
Molecular Weight:
216.12
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Assay
99%
form
solid
bp
156-158 °C/18 mmHg (lit.)
mp
44-47 °C (lit.)
SMILES string
[O-][N+](=O)c1cc(ccc1C#N)C(F)(F)F
InChI
1S/C8H3F3N2O2/c9-8(10,11)6-2-1-5(4-12)7(3-6)13(14)15/h1-3H
InChI key
BQCWLXXZTCLGSZ-UHFFFAOYSA-N
Application
2-Nitro-4-(trifluoromethyl)benzonitrile was used in the preparation of 2-nitro-4-(trifluoromethyl)benzaldehyde.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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Studies on the rearrangement of ortho-nitrobenzylidenemalonates and their Analogues to 2-aminobenzoate derivatives.
Lewandowska E, et al.
Canadian Journal of Chemistry, 80(2), 192-199 (2002)
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