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About This Item
Linear Formula:
CF3C6H4CH2CN
CAS Number:
Molecular Weight:
185.15
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
221-239-9
MDL number:
Assay:
98%
InChI key
QXDCZSJGEUSERL-UHFFFAOYSA-N
InChI
1S/C9H6F3N/c10-9(11,12)8-4-2-1-3-7(8)5-6-13/h1-4H,5H2
SMILES string
FC(F)(F)c1ccccc1CC#N
assay
98%
mp
32-35 °C (lit.)
functional group
fluoro, nitrile
Application
2-(Trifluoromethyl)phenylacetonitrile was used in the facile synthesis of 1,2,3,4-tetrasubstituted naphthalenes via the condensation reaction with aromatic acetonitriles under basic conditions.
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
10 - Combustible liquids
wgk
WGK 3
flash_point_f
192.2 °F - closed cup
flash_point_c
89 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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A facile one-pot synthesis of polysubstituted naphthalenes.
Kiselyov, AS.
Tetrahedron Letters, 42(17), 3053-3056 (2001)
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