6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXALDEHYDE
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6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXALDEHYDE
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CAS No:
386704-12-7
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Formula:
C7H4F3NO
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Chemical Name:
6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXALDEHYDE
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Synonyms:
6-(TrifluoroMethyl)-3-pyridinecarboxaldehyde;5-Formyl-2-(trifluoromethyl)pyridine, 6-(Trifluoromethyl)pyridine-3-carboxaldehyde;6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXALDEHYDE, 6-TRIFLUOROMETHYL-PYRIDINE-3-CARBALDEHYDE;6-(Trifluoromethyl)pyridine-3-carboxaldehyde 95%;6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXALDEHYDE;6-(TRIFLUOROMETHYL)NICOTINALDEHYDE;2-(Trifluoromethyl)pyridine-5-carboxaldehyde;2-(Trifluoromethyl)pyridine-5-carboxaldehyde 97%
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CAS No:
6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXALDEHYDE Basic Attributes
175.11
175.024506
1308068-626-2
DTXSID90380641
2933399090
Safety Information
6.1
UN28116.1/PG3
3
36/37/38-43-25
26-36/37/39-36/37-28
Xi,T
Irritant
P261-P280-P301 + P310-P305 + P351 + P338
H301-H315-H317-H319-H335
|Danger|H301 (96.95%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P272, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 131 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXALDEHYDE Use and Manufacturing
Intermediate 174: 6-(trifluoromethyl)nicotinaldehvde; To a solution of 800 mg of 6-(trifluoromethyl)pyridin-3-yl)methanol (intermediate 173, 4.52 mmole) in 50 mL of DCM cooled at 0A solution of [6-(trifluoromethyl)pyridine-3-yl]methanol (0.886 g, 5.0 mmol) in DCM (20 ml) was added to a mixture of Dess-Martin periodinane (2.334 g, 5.5 mmol) in DCM (20 ml) at rt. The reaction was stirred for 1.5 hrs then diluted with EtExample 1(+/-) {(25'*, 4λ*)-l-{(lλ*)-4-methyl-l-[6-(trifluoromethyl)pyridin-3-yl]pent-4-en-2-yn-l-yl}-2-[4- (trifluoromethyl)phenyl]piperidin-4-yl}acetic acidStep 1: 6-(Trifluoromethyl)nicotinaldehydeA solution of [6-(trifluoromethyl)pyridine-3-yl]methanol (0.886g, 5.0mmol) in DCM (20ml) was added to a mixture of Dess-Martin periodinane (2.334g, 5.5mmol) in DCM (20ml) at rt. The reaction was stirred for 1.5 hrs then diluted with Et(2) The iso-sea pine hydrazide prepared in the step (1) and 16.5 mmol
Computed Properties
Molecular Weight:175.11
XLogP3:1.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:175.02449824
Monoisotopic Mass:175.02449824
Topological Polar Surface Area:30
Heavy Atom Count:12
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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6-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXALDEHYDE
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