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About This Item
Linear Formula:
(CF3)2C6H3CHO
CAS Number:
Molecular Weight:
242.12
Beilstein:
1884058
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
97%
refractive index
n20/D 1.422 (lit.)
bp
37 °C/1.3 mmHg (lit.)
density
1.469 g/mL at 25 °C (lit.)
functional group
aldehyde
fluoro
SMILES string
[H]C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
InChI
1S/C9H4F6O/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-4H
InChI key
LDWLIXZSDPXYDR-UHFFFAOYSA-N
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Application
3,5-Bis(trifluoromethyl)benzaldehyde was used in the synthesis of of a series of meso-3,5-bis(trifluoromethyl)phenyl-substituted expanded porphyrins.
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
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
156.2 °F - closed cup
Flash Point(C)
69 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Soonchul Kang et al.
Chemistry, an Asian journal, 3(12), 2065-2074 (2008-11-14)
Trifluoroacetic acid-catalyzed condensation of pyrrole with electron-deficient and sterically hindered 3,5-bis(trifluoromethyl)benzaldehyde results in the unexpected production of a series of meso-3,5-bis(trifluoromethyl)phenyl-substituted expanded porphyrins including [22]sapphyrin 2, N-fused [22]pentaphyrin 3, [26]hexaphyrin 4, and intact [32]heptaphyrin 5 together with the conventional 5,10,15,20-tetrakis(3,5-bis(trifluoromethyl)phenyl)porphyrin
M M V Ramana et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 152, 165-171 (2015-07-25)
In the present work, isopropyl-6-amino-4-(3,5-bis(trifluoromethyl)phenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate (4H-pyran analog) has been synthesized by a three component reaction catalyzed by CsOH/γ-Al2O3 and characterized. The interaction of 4H-pyran analog with herring sperm DNA (hs DNA) under physiological conditions (phosphate buffer of pH 7.2) was
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