ethanol
A
triethyl borate
B
bis(4-methoxy-3,5-dimethylphenyl)-phosphine
Conditions | Yield |
---|---|
Inert atmosphere; Reflux; | A n/a B 73% |
ethyl trimethylsilyl ether
benzenediazonium tetrafluoroborate
A
triethyl borate
B
trimethylsilyl fluoride
C
Phenetole
Conditions | Yield |
---|---|
In 1,1,2-Trichloro-1,2,2-trifluoroethane 1.) 0 to 55 deg C very slowly, 2.) sonication, reflux, 16-17 h; | A 63% B n/a C 54% |
nido-decaborane
ethyl nitrite
A
nido-NB9H12
B
triethyl borate
Conditions | Yield |
---|---|
In tetrahydrofuran byproducts: H2, NO, NO2; addn. of ethylnitrite soln. to borane soln., -78°C; heating to room temp.; stirring, 3h; evapn.; extn. (hexane); evapn.; sublimation, 25°C, 0.001 Torr; | A 52% B n/a |
ethanol
(2-biphenyl)dicyclohexylphosphane-borane(1:1)
A
triethyl borate
B
CyJohnPhos
Conditions | Yield |
---|---|
Inert atmosphere; Reflux; | A n/a B 52% |
boric acid
triethyl borate
Conditions | Yield |
---|---|
With ethanol In benzene a mixt. of ethanol, benzene, orthoboric acid, and anhydrous CuSO4 is boiled on a Dean-Stark apparatus with driving off water (40-50 h);; repeated fractional distn.;; | 35% |
With ethanol | |
With ethanol In ethanol at room temp.; | |
With ethanol In ethanol at room temp.; | |
With C2H5OH |
Conditions | Yield |
---|---|
With sulfuric acid |
Conditions | Yield |
---|---|
With boron trichloride | |
With sodium borate; acetic acid | |
With boron trichloride at -60℃; im Hochvakuum; |
bis(ethoxy)chloroborane
triethyl borate
Conditions | Yield |
---|---|
With sodium | |
With zinc |
Conditions | Yield |
---|---|
With tert-butyl-N-methyl-N-isopropylamine-borane In tetrahydrofuran at 20℃; for 24h; Reduction; |
triethyl borate
carbon monoxide
1-bromomethyl-3-methyl-benzene
ethyl m-methylphenylacetate
Conditions | Yield |
---|---|
1,5-hexadienerhodium(I)-chloride dimer at 75℃; under 760 Torr; Heating; overnight; other solvent; | 100% |
triethyl borate
2-Methoxybenzyl chloride
ethyl (2-methoxyphenyl)acetate
Conditions | Yield |
---|---|
With potassium iodide; <1,5-HDRhCl>2 | 100% |
triethyl borate
tert-butyl-dimethyl-(4-bromo-2-ethyl-5-methoxy-benzyloxy)-silane
tert-butyl-dimethyl-(4-boronic acid-2-ethyl-5-methoxy-benzyloxy)-silane
Conditions | Yield |
---|---|
Stage #1: tert-butyl-dimethyl-(4-bromo-2-ethyl-5-methoxy-benzyloxy)-silane With n-butyllithium In tetrahydrofuran at -78 - -70℃; for 1h; Stage #2: triethyl borate In tetrahydrofuran at -30 - 23℃; for 2h; | 100% |
With n-butyllithium In tetrahydrofuran | 9.0 g (100%) |
Conditions | Yield |
---|---|
In benzene byproducts: ethanol; molar ratio B(OEt)3:alcohol=1:3, refluxing; distn. (reduced pressure); elem. anal.; | 100% |
triethyl borate
2-(4-bromo-2,5-dimethoxy-phenyl)-[1,3]dioxolane
2-(4-boronic acid-2,5-dimethoxy-phenyl)-[1,3]dioxolane
Conditions | Yield |
---|---|
Stage #1: 2-(4-bromo-2,5-dimethoxy-phenyl)-[1,3]dioxolane With n-butyllithium In tetrahydrofuran at -78 - -70℃; for 0.5h; Stage #2: triethyl borate In tetrahydrofuran at -30 - 23℃; for 2h; | 100% |
triethyl borate
[2-(4-Bromo-2-ethyl-5-methoxy-phenyl)-ethoxy]-tert-butyl-dimethyl-silane
[2-(4-boronic acid-2-ethyl-5-methoxy-phenyl)-ethoxy]-tert-butyl-dimethyl-silane
Conditions | Yield |
---|---|
Stage #1: [2-(4-Bromo-2-ethyl-5-methoxy-phenyl)-ethoxy]-tert-butyl-dimethyl-silane With n-butyllithium In tetrahydrofuran at -78 - -70℃; for 1h; Stage #2: triethyl borate In tetrahydrofuran at -30 - 23℃; for 2h; | 100% |
triethyl borate
1-bromo-3,5-diphenylbenzene
3,5-diphenylphenylboronic acid
Conditions | Yield |
---|---|
Stage #1: 1-bromo-3,5-diphenylbenzene With n-butyllithium In tetrahydrofuran at -78℃; for 2h; Inert atmosphere; Stage #2: triethyl borate In tetrahydrofuran at -78℃; for 24h; Inert atmosphere; | 97% |
triethyl borate
trimethyl(pentafluoroethyl)silane
Conditions | Yield |
---|---|
With potassium fluoride In tetrahydrofuran at 20 - 50℃; for 8h; | 96% |
Conditions | Yield |
---|---|
In benzene addn. of ligand to boron ethoxide in dry benzene, refluxing over a fractionating column; removal of solvent, drying under reduced pressure, elem. anal.; | 96% |
triethyl borate
(trifluoromethyl)trimethylsilane
Conditions | Yield |
---|---|
With potassium fluoride In tetrahydrofuran at 20℃; for 24h; | 95% |
With potassium fluoride In 1,2-dimethoxyethane at 20℃; |
Conditions | Yield |
---|---|
In benzene byproducts: ethanol; molar ratio B(OEt)3:alcohol=1:3, refluxing; distn. (reduced pressure); elem. anal.; | 95% |
triethyl borate
Conditions | Yield |
---|---|
In benzene addn. of ligand to boron ethoxide in dry benzene, refluxing over a fractionating column; removal of solvent, drying under reduced pressure, elem. anal.; | 95% |
Conditions | Yield |
---|---|
With tris(pentafluorophenyl)borate In benzene at 85℃; for 3h; | 95% |
triethyl borate
2-[(1,1-dimethylethyl)amino]-ethanol
B(OCH2CH2NHC(CH3)3)3
Conditions | Yield |
---|---|
In benzene byproducts: ethanol; molar ratio B(OEt)3:alcohol=1:3, refluxing; distn. (reduced pressure); elem. anal.; | 94% |
Conditions | Yield |
---|---|
Stage #1: C10H12N4O3(2-)*2Na(1+) With sulfuric acid In 1,4-dioxane; acetonitrile at 0℃; Stage #2: triethyl borate In 1,4-dioxane; acetonitrile at 50℃; | 94% |
triethyl borate
Conditions | Yield |
---|---|
Stage #1: N,N'-di-tert-butoxycarbonyl-2,2'-bipyrrole With 2,2,6,6-tetramethyl-piperidine; n-butyllithium In tetrahydrofuran; hexane at -78℃; for 3h; Inert atmosphere; Stage #2: triethyl borate In tetrahydrofuran; hexane at -78 - 20℃; for 18.5h; Inert atmosphere; | 94% |
triethyl borate
1-chloromethyl-4-fluorobenzene
ethyl 2-(4-fluorophenyl)acetate
Conditions | Yield |
---|---|
With potassium iodide; <1,5-HDRhCl>2 | 93% |
Conditions | Yield |
---|---|
With tert-amyl peroxy-2-ethylhexanoate at 75 - 90℃; Sealed tube; Cooling with acetone-dry ice; | 92.4% |
The IUPAC name of this chemical is triethyl borate. With the CAS registry number 150-46-9, it is also named as Boric acid, triethyl ester. The product's categories are Organometallics; B (Classes of Boron Compounds); Boric Acid Esters; Boric Acid Triesters. It is clear colourless liquid which reacts easily with water. Additionally, this chemical should be sealed in the container and stored in the cool and dry place at the temperature of 0-6 °C.
The other characteristics of this product can be summarized as: (1)ACD/LogP: 3.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.04; (4)ACD/LogD (pH 7.4): 3.04; (5)ACD/BCF (pH 5.5): 121.31; (6)ACD/BCF (pH 7.4): 121.31; (7)ACD/KOC (pH 5.5): 1079.6; (8)ACD/KOC (pH 7.4): 1079.6; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Index of Refraction: 1.374; (13)Molar Refractivity: 38.51 cm3; (14)Molar Volume: 168.6 cm3; (15)Surface Tension: 22.3 dyne/cm; (16)Enthalpy of Vaporization: 34.33 kJ/mol; (17)Vapour Pressure: 18.6 mmHg at 25°C; (18)Rotatable Bond Count: 6; (19)Exact Mass: 146.111425; (20)MonoIsotopic Mass: 146.111425; (21)Topological Polar Surface Area: 27.7; (22)Heavy Atom Count: 10; (23)Complexity: 55.7.
Preparation of Triethyl borate: It can be obtained by dissolving boric acid in ethanol. The equilibrium reaction is as following:
B(OH)3 + 3 C2H5OH (C2H5O)3B + 3 H2O
Uses of Triethyl borate: It is used as a solvent and/or catalyst in preparation of synthetic waxes, resins, paints, and varnishes. It is also used as a component of some flame retardants in textile industry and of some welding fluxes.In addition, it can react with 1-bromomethyl-3-methyl-benzene and carbon monoxide to get m-tolyl-acetic acid ethyl ester. This reaction needs catalytic agent 1,5-hexadieneρdium chloride at temperature of 75 °C and the pressure of 760.0002. The yield is 100%.
When you are using this chemical, please be cautious about it as the following:
It is highly flammable, so people should keep it away from sources of ignition. When use it, people must not breathe vapour. And take precautionary measures against static discharges.
People can use the following data to convert to the molecule structure.
1. SMILES:O(B(OCC)OCC)CC
2. InChI:InChI=1/C6H15BO3/c1-4-8-7(9-5-2)10-6-3/h4-6H2,1-3H3
3. InChIKey:AJSTXXYNEIHPMD-UHFFFAOYAB
The following are the toxicity data which has been tested.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 2100mg/kg (2100mg/kg) | "Boron, Metallo-Boron Compounds and Boranes," Adams, R.M., ed., New York, John Wiley & Sons, Inc., 1964Vol. -, Pg. 693, 1964. |
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