Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2,8-Bis(trifluoromethyl)-4-bromoquinoline |
EINECS | 609-183-7 | ||||||||
CAS No. | 35853-45-3 | Density | 1.72g/cm3 | ||||||||
PSA | 12.89000 | LogP | 5.03490 | ||||||||
Solubility | N/A | Melting Point |
62-64 °C(lit.) |
||||||||
Formula | C11H4 Br F6 N | Boiling Point | 281.6°Cat760mmHg | ||||||||
Molecular Weight | 344.054 | Flash Point | 124.1°C | ||||||||
Transport Information | N/A | Appearance | N/A | ||||||||
Safety |
|
Risk Codes | R36/37/38 | ||||||||
Molecular Structure | Hazard Symbols | ||||||||||
Synonyms |
2,8-Bis(trifluoromethyl)-4-bromoquinoline;4-Bromo-2,8-bis(trifluoromethyl)quinoline; |
Article Data | 15 |
2,8-bis(trifluoromethyl)quinolin-4-ol
(2,8-bis-trifluoromethyl)-4-bromoquinoline
Conditions | Yield |
---|---|
With phosphorus(V) oxybromide | 99% |
With phosphorus(V) oxybromide at 120℃; for 5h; Inert atmosphere; | 98% |
With phosphorus(V) oxybromide at 140℃; Inert atmosphere; | 98% |
2,8-bis(trifluoromethyl)quinolin-4-yl 4-methylbenzenesulfonate
(2,8-bis-trifluoromethyl)-4-bromoquinoline
Conditions | Yield |
---|---|
With phosphorus; bromine In acetic acid at 25℃; for 4h; | 80% |
(2,8-bis-trifluoromethyl)-4-bromoquinoline
N-benzhydryl 3-azetidinone
3-(2,8-bis(trifluoromethyl)-4-quinolinyl)-1-diphenylmethyl-3-azetidinol
Conditions | Yield |
---|---|
With n-butyllithium In water | 100% |
(2,8-bis-trifluoromethyl)-4-bromoquinoline
para-thiocresol
2,8-bis(trifluoromethyl)-4-quinolyl p-tolylsulphide
Conditions | Yield |
---|---|
With potassium hydroxide In methanol; ethanol at 60℃; for 2h; | 95% |
ferrocenecarboxaldehyde
(2,8-bis-trifluoromethyl)-4-bromoquinoline
Conditions | Yield |
---|---|
Stage #1: (2,8-bis-trifluoromethyl)-4-bromoquinoline With n-butyllithium In diethyl ether; hexane at -78℃; for 0.333333h; Inert atmosphere; Schlenk technique; Stage #2: ferrocenecarboxaldehyde In diethyl ether; hexane at -78℃; for 2h; Inert atmosphere; Schlenk technique; | 94% |
(2,8-bis-trifluoromethyl)-4-bromoquinoline
2,8-bis(trifluoromethyl)-4-vinylquinoline
Conditions | Yield |
---|---|
With dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH2Cl2 Suzuki Coupling; | 94% |
(2,8-bis-trifluoromethyl)-4-bromoquinoline
copper(I) cyanide
Conditions | Yield |
---|---|
In N,N-dimethyl-formamide Substitution; Heating; | 93% |
piperazine
(2,8-bis-trifluoromethyl)-4-bromoquinoline
Conditions | Yield |
---|---|
With potassium carbonate; triethylamine at 135℃; for 4h; | 92% |
(2,8-bis-trifluoromethyl)-4-bromoquinoline
1-acetoxy-1'-(1,3-dioxan-2-yl)ferrocene
1-(1,3-dioxan-2-yl)-1'-(2,8-bis(trifluoromethyl)quinolin-4-yloxy)-ferrocene
Conditions | Yield |
---|---|
Stage #1: 1-acetoxy-1'-(1,3-dioxan-2-yl)ferrocene With sodium methylate In N,N-dimethyl-formamide at 20℃; for 2h; Inert atmosphere; Schlenk technique; Stage #2: (2,8-bis-trifluoromethyl)-4-bromoquinoline In N,N-dimethyl-formamide at 150℃; for 6h; Inert atmosphere; Schlenk technique; | 92% |
(2,8-bis-trifluoromethyl)-4-bromoquinoline
carbon dioxide
2,8-bis-(trifluoromethyl)-quinoline-4-carboxylic acid
Conditions | Yield |
---|---|
With n-butyllithium In diethyl ether at -35℃; for 0.333333h; | 86% |
1.Introduction of 2,8-Bis(trifluoromethyl)-4-bromoquinoline
The 2,8-Bis(trifluoromethyl)-4-bromoquinoline, with its CAS NO 35853-45-3, is a kind of yellow solid. It has synonyms of 2,8-Bis(trifluoromethyl)-4-bromoquinoline and 4-Bromo-2,8-bis(trifluoromethyl)quinoline. 2,8-Bis(trifluoromethyl)-4-bromoquinoline should be stored in shady and cool warehouse and mainly used as pharmaceutical intermediate.
2.Properties of 2,8-Bis(trifluoromethyl)-4-bromoquinoline
(1) Polar Surface Area: 12.89 Å2 (2) Index of Refraction: 1.51 (3) Molar Refractivity: 59.83 cm3
(4) Molar Volume: 199.9 cm3 (5) Polarizability: 23.72 ×10-24 cm3 (6) Surface Tension: 30.5 dyne/cm
(7) Density: 1.72 g/cm3 (8) Flash Point: 124.1 °C (9) Enthalpy of Vaporization: 49.95 kJ/mol
(10) Boiling Point: 281.6 °C at 760 mmHg (11) Vapour Pressure: 0.00603 mmHg at 25°C
3.Structure descriptors of 2,8-Bis(trifluoromethyl)-4-bromoquinoline
IUPAC Name: 4-bromo-2,8-bis(trifluoromethyl)quinoline
InChI: InChI=1S/C11H4BrF6N/c12-7-4-8(11(16,17)18)19-9-5(7)2-1-3-6(9)10(13,
14)15/h1-4H
InChIKey: DXALAFAFIXJDOS-UHFFFAOYSA-N
Canonical SMILES : C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2Br)C(F)(F)F
4. Safety information of 2,8-Bis(trifluoromethyl)-4-bromoquinoline
Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39: Wear suitable gloves and eye/face protection.
WGK Germany: 3