Conditions | Yield |
---|---|
Stage #1: benzaldehyde; ethanolamine In methanol at 20℃; for 0.25h; Stage #2: With methanol; sodium tetrahydroborate at 0 - 20℃; | 100% |
With copper chromium spinel oxide; hydrogen; barium(II) oxide at 130℃; under 37503 Torr; for 1h; | 97.8% |
Stage #1: benzaldehyde; ethanolamine With magnesium sulfate In methanol at 20℃; for 18h; Stage #2: With sodium tetrahydroborate In methanol at 0 - 20℃; for 1h; | 95% |
[benzyl-(2-hydroxyethyl)-amino]-acetonitrile
N-Benzylethanolamine
Conditions | Yield |
---|---|
With hydrogen; platinum(IV) oxide In ethanol | 98% |
N-Benzylethanolamine
Conditions | Yield |
---|---|
With methanol; 1,3-disulfonic acid imidazolium hydrogen sulfate at 20℃; for 0.0666667h; Green chemistry; | 97% |
Conditions | Yield |
---|---|
With diborane In tetrahydrofuran for 5h; Heating; | 96% |
With lithium aluminium tetrahydride In diethyl ether |
Conditions | Yield |
---|---|
With sodium cyanoborohydride In methanol at 20℃; for 12h; Inert atmosphere; Cooling with ice; | 94% |
With hydrogen; palladium on activated charcoal Yield given; | |
With sodium tetrahydroborate In methanol at 5 - 20℃; |
Conditions | Yield |
---|---|
With Dowex 1*8-100 resin (hydroxide form) In tetrahydrofuran; methanol at 20℃; for 18h; | 94% |
2-oxo-3-phenylmethyl-1,2,3-oxathiazolidine
N-Benzylethanolamine
Conditions | Yield |
---|---|
With thiophenol In methanol at 20℃; for 0.5h; | 84% |
Conditions | Yield |
---|---|
In N,N-dimethyl-formamide for 1h; Heating; | 80% |
N-Benzylethanolamine
Conditions | Yield |
---|---|
With sodium tetrahydroborate In ethanol at 20℃; for 1h; | 80% |
C9H11NO
N-Benzylethanolamine
Conditions | Yield |
---|---|
With sodium tetrahydroborate In methanol at 0℃; for 3h; Inert atmosphere; Reflux; | 79% |
N-benzyl-2-(benzyloxy)ethan-1-amine
N-Benzylethanolamine
Conditions | Yield |
---|---|
With triphenylphosphine hydrobromide In acetonitrile at 100℃; for 0.5h; Microwave irradiation; sealed tube; | 72% |
Conditions | Yield |
---|---|
With 1-(3-amino-2,4-dihydroxyphenyl)-1-ethanone In methanol at 20℃; for 4h; Inert atmosphere; Electrochemical reaction; chemoselective reaction; | 68% |
Conditions | Yield |
---|---|
With sodium tetrahydroborate; iodine In tetrahydrofuran Heating; | 64% |
With lithium aluminium tetrahydride |
(E)-2-(benzylideneamino)ethanol
N-Benzylethanolamine
Conditions | Yield |
---|---|
With sodium tetrahydroborate In ethanol at 0 - 20℃; for 21h; | 61.3% |
With sodium tetrahydroborate In ethanol at 0 - 20℃; |
N-benzyl-β-vinyloxyethylamine
N-Benzylethanolamine
Conditions | Yield |
---|---|
With sulfuric acid at 20℃; for 3h; Heating; | 60% |
Conditions | Yield |
---|---|
With potassium carbonate In N,N-dimethyl-formamide at 20℃; for 6h; | 58% |
3-benzylcyclohexanospiro-2-oxazolidine
A
1-benzyl-4,5,6,7-tetrahydro-1H-indole
B
N-Benzylethanolamine
C
cyclohexanol
Conditions | Yield |
---|---|
With potassium hydroxide Heating; CH3ONa as reagent; | A 43% B n/a C n/a |
oxirane
benzylamine
A
N-benzyl-diethanolamine
B
N-Benzylethanolamine
Conditions | Yield |
---|---|
With lithium aluminium tetrahydride | |
With borane In tetrahydrofuran | |
With lithium aluminium tetrahydride In tetrahydrofuran |
Conditions | Yield |
---|---|
With ethanol; sodium Durch Reduktion; |
2-chloroethyl N-benzylcarbamate
N-Benzylethanolamine
Conditions | Yield |
---|---|
With sodium hydroxide at 80℃; |
benzyl chloride
ethanolamine
A
N,N-dibenzyl-2-aminoethanol
B
N-Benzylethanolamine
Conditions | Yield |
---|---|
With sodium hydroxide; ethanol |
1-benzyl-4,5-dihydro-1H-[1,2,3]triazole
A
1-benzylaziridine
B
acetaldehyde
C
benzylamine
D
N-Benzylethanolamine
Conditions | Yield |
---|---|
With water at 25℃; Rate constant; Product distribution; Mechanism; pH 10.75 (lysine buffer); other solvent, other pH (other buffer concentration, other buffer), H/D isotope effect; |
benzyl bromide
ethanolamine
A
O-benzylethanolamine
B
N-benzyl-2-(benzyloxy)ethan-1-amine
C
N-Benzylethanolamine
Conditions | Yield |
---|---|
With sodium hydride; tetra(tert-butyl)-ammonium fluoride 1.) THF, reflux, 0.5 h, 2.) THF, 20 deg C, 3 h; Yield given. Multistep reaction. Yields of byproduct given. Title compound not separated from byproducts; | |
With sodium hydride; tetra(tert-butyl)-ammonium fluoride 1.) THF, reflux, 0.5 h, 2.) THF, 20 deg C, 3 h; Yield given. Multistep reaction. Yields of byproduct given; |
benzyl chloride
ethanolamine
A
O-benzylethanolamine
B
N-benzyl-2-(benzyloxy)ethan-1-amine
C
N-Benzylethanolamine
Conditions | Yield |
---|---|
With sodium hydride 1.) THF, reflux, 0.5 h, 2.) TH , reflux, 2 h; Yield given. Multistep reaction. Yields of byproduct given; |
bromoacetic acid methyl ester
N-Benzylethanolamine
4-benzyl-morpholin-2-one
Conditions | Yield |
---|---|
With potassium carbonate In acetonitrile at 0 - 20℃; for 24h; Reagent/catalyst; Solvent; | 100% |
With toluene-4-sulfonic acid; triethylamine 1.) benzene, r.t., 12 h, 2.) benzene, reflux, 1 d; Yield given. Multistep reaction; |
2-Chloroacrylonitrile
N-Benzylethanolamine
3-(benzyl(2-hydroxyethyl)amino)-2-chloro-propanenitrile
Conditions | Yield |
---|---|
In diethyl ether at 40℃; | 100% |
In diethyl ether for 120h; Ambient temperature; | |
at 15 - 29℃; Neat (no solvent); |
di-tert-butyl dicarbonate
N-Benzylethanolamine
N-(tert-butoxycarbonyl)-N-benzylethanolamine
Conditions | Yield |
---|---|
In tetrahydrofuran | 100% |
In acetonitrile at 20℃; Condensation; | 100% |
With sodium hydroxide In dichloromethane; water at 20℃; for 24h; | 100% |
N-Benzylethanolamine
2-(3-fluorophenyl)acetaldehyde
2-[benzyl(3'-fluorophenethyl)amino]ethanol
Conditions | Yield |
---|---|
With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane | 100% |
With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane at 20℃; for 14h; Inert atmosphere; | 100% |
With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane | 100% |
With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane at 20℃; for 14h; | 100% |
With sodium tris(acetoxy)borohydride at 20℃; for 14h; | 91% |
N-Benzylethanolamine
2-oxo-3-phenylmethyl-1,2,3-oxathiazolidine
Conditions | Yield |
---|---|
With 1H-imidazole; sulfuryl dichloride; triethylamine In dichloromethane at 0℃; for 1h; pH=15; | 100% |
bromoacetic acid tert-butyl ester
N-Benzylethanolamine
tert-butyl 2-(benzyl-(2-hydroxyethyl)amino)-acetate
Conditions | Yield |
---|---|
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 0 - 20℃; for 24h; | 100% |
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 24h; | 100% |
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 0 - 25℃; for 12h; | 100% |
2-Chloro-pyridin-3-yl acetic acid
N-Benzylethanolamine
N-benzyl-2-(2-chloropyridin-3-yl)-N-(2-hydroxyethyl)acetamide
Conditions | Yield |
---|---|
With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In N,N-dimethyl-formamide at 20℃; for 96h; | 100% |
tert-butyldicarbonate
N-Benzylethanolamine
N-(tert-butoxycarbonyl)-N-benzylethanolamine
Conditions | Yield |
---|---|
With sodium hydroxide In dichloromethane; water at 20℃; for 24h; | 100% |
phenylacetaldehyde
N-Benzylethanolamine
2-[benzyl(phenethyl)amino]ethanol
Conditions | Yield |
---|---|
With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane at 20℃; for 14h; Inert atmosphere; | 100% |
4-fluorophenylacetaldehyde
N-Benzylethanolamine
2-[benzyl(4'-fluorophenethyl)amino]ethanol
Conditions | Yield |
---|---|
With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane at 20℃; for 14h; Inert atmosphere; | 100% |
Conditions | Yield |
---|---|
In dichloromethane at 0 - 20℃; | 100% |
In dichloromethane at 0 - 20℃; |
3-chloro-5-[(3R)-3-methylmorpholin-4-yl]pyrazine-2-carbaldehyde
N-Benzylethanolamine
2-[benzyl({3-chloro-5-[(3R)-3-methylmorpholin-4-yl]pyrazin-2-yl}methyl)amino]ethanol
Conditions | Yield |
---|---|
With sodium tris(acetoxy)borohydride; acetic acid In acetonitrile at 10 - 30℃; | 100% |
N-Benzylethanolamine
3-benzyl-2-(2-methylhex-5-en-3-yl)oxazolidine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
N-Benzylethanolamine
3-benzyl-2-(7-benzyloxyhept-1-en-4-yl)oxazolidine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
2-(2-bromophenyl)pent-4-enal
N-Benzylethanolamine
3-benzyl-2-(1-(2-bromophenyl)but-3-enyl)oxazolidine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
2-(dibenzylamino)pent-4-enal
N-Benzylethanolamine
N,N-dibenzyl-1-(3-benzyloxazolidin-2-yl)but-3-en-1-amine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
2-trityloxypent-4-enal
N-Benzylethanolamine
3-benzyl-2-(3-trityloxybut-3-en-4-yl)oxazolidine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
2-trityloxymethylpent-4-enal
N-Benzylethanolamine
3-benzyl-2-(1-trityloxypent-3-enyl)oxazoline
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
(E)-2-allyl-5-phenylpent-4-enal
N-Benzylethanolamine
3-benzyl-2-((E)-1-phenylhepta-1,6-dien-4-yl)oxazoline
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
2-phenyl-4-penten-1-al
N-Benzylethanolamine
3-benzyl-2-(1-phenylbut-3-enyl)oxazolidine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
tert-butyl (S)-(1-oxopent-4-en-2-yl)carbamate
N-Benzylethanolamine
tert-butyl (S)-1-(3-benzyloxazolidin-2-yl)but-3-enylcarbamate
Conditions | Yield |
---|---|
In benzene at 50℃; for 2h; Inert atmosphere; | 100% |
2-propenyl-octanal
N-Benzylethanolamine
3-benzyl-2-(dec-1-en-4-yl)oxazolidine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
(+/-)-α-allyl-α-(p-methoxyphenyl)acetaldehyde
N-Benzylethanolamine
3-benzyl-2-[1-(4-methoxyphenyl)but-3-enyl]oxazolidine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
2-(benzyloxy)-4-pentenal
N-Benzylethanolamine
3-benzyl-2-(3-benzyloxybut-3-en-4-yl)oxazolidine
Conditions | Yield |
---|---|
In toluene for 3h; Inert atmosphere; Heating; | 100% |
3-chloro-5-[methyl(propan-2-yl)amino]pyrazine-2-carbaldehyde
N-Benzylethanolamine
2-[benzyl({3-chloro-5-[methyl(1-methylethyl)amino]pyrazin-2-yl}methyl)amino]ethanol
Conditions | Yield |
---|---|
With sodium tris(acetoxy)borohydride; acetic acid In acetonitrile at 10 - 30℃; for 5h; | 100% |
tert-Butyl chloroacetate
N-Benzylethanolamine
tert-butyl 2-(benzyl-(2-hydroxyethyl)amino)-acetate
Conditions | Yield |
---|---|
With potassium carbonate; sodium iodide In acetonitrile Inert atmosphere; Reflux; | 100% |
Conditions | Yield |
---|---|
With potassium carbonate In acetonitrile at 80℃; for 1.5h; | 100% |
With potassium carbonate In acetonitrile |
N-Benzylethanolamine
(S)-Propylene oxide
Conditions | Yield |
---|---|
at 100℃; for 1h; Microwave irradiation; | 100% |
bromoacetic acid methyl ester
N-Benzylethanolamine
methyl 2-(benzyl(2-hydroxyethyl)amino)acetate
Conditions | Yield |
---|---|
With N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃; for 24h; Reagent/catalyst; Solvent; | 100% |
The Ethanol,2-[(phenylmethyl)amino]-, with CAS registry number 104-63-2, belongs to the following product category: Hydroxyethylamines. It has the systematic name of 2-(benzylamino)ethanol. This chemical is a kind of clear colorless to light yellow liquid. What's more, its EINECS is 203-221-2.
Physical properties of Ethanol,2-[(phenylmethyl)amino]-: (1)ACD/LogP: 1.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.79; (4)ACD/LogD (pH 7.4): -0.34; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 3.38; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.54; (14)Molar Refractivity: 45.56 cm3; (15)Molar Volume: 145 cm3; (16)Polarizability: 18.06×10-24cm3; (17)Surface Tension: 41.5 dyne/cm; (18)Enthalpy of Vaporization: 55.35 kJ/mol; (19)Vapour Pressure: 0.00134 mmHg at 25°C.
Uses of Ethanol,2-[(phenylmethyl)amino]-: it can be used to produce benzylamine and N-benzyl-formamide. This reaction will need reagent sodium metaperiodate and solvent H2O, methanol. The reaction time is 4 hour(s). The yield is about 61%.
When you are using this chemical, please be cautious about it as the following:
The Trimesic acid irritates to eyes, respiratory system and skin. When use it, do not breathe vapour and avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)SMILES: OCCNCc1ccccc1
(2)InChI: InChI=1/C9H13NO/c11-7-6-10-8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2
(3)InChIKey: XNIOWJUQPMKCIJ-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C9H13NO/c11-7-6-10-8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2
(5)Std. InChIKey: XNIOWJUQPMKCIJ-UHFFFAOYSA-N
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