3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole supplier

Name
1,3-Dihydro-3,3-dimethyl-1-(trifluoromethyl)-1,2-benziodoxole, Tognis Reagent
EINECS
CAS No. 887144-97-0
Article Data11
CAS DataBase
Density
Solubility
Melting Point 75-79 oC
Formula C₁₀H₁₀F₃IO
Boiling Point
Molecular Weight 330.089
Flash Point
Transport Information
Appearance
Safety Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36/37
Risk Codes R36/37/38
Molecular Structure
Hazard Symbols
Synonyms 1,3-Dihydro-3,3-dimethyl-1-(trifluoromethyl)-1,2-benziodoxole, Tognis Reagent;3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole;1-Trifluoromethyl-3,3-dimethyl-1,2-benziodoxole;Tognis Reagent;1,3-dihydro-3,3-diMethyl-1-(trifluoroMethyl)-1,2-benziodoxole;1,3-Dhydro-3,3-diMethyl-1-(trifluoroMethyl)-1,2-benziodoxole;3,3-DMethyl-1-(trifluoroMethyl)-1,2-benziodoxole;1,3-Dihydro-3,3-diMethyl-1-(trifluoroMethyl)-1,2-b
PSA 9.23000
LogP 4.06270

Synthetic route

: 69352-04-1
1-chloro-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole

: 81290-20-2
(trifluoromethyl)trimethylsilane

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
With fluoride In acetonitrile	93%
With potassium acetate; tetrabutylammonium triphenyldifluorosilicate In acetonitrile at -17 - 20℃; for 22h;	89%
Stage #1: 1-chloro-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole With potassium acetate In acetonitrile at 20℃; for 1h; Schlenk technique; Inert atmosphere; Stage #2: (trifluoromethyl)trimethylsilane With tetrabutylammonium triphenyldifluorosilicate In acetonitrile at -17 - 20℃; for 19h; Schlenk technique; Inert atmosphere;	85%

: 81290-20-2
(trifluoromethyl)trimethylsilane

: 175786-58-0
3,3-dimethyl-1λ3-benzo[d][1,2]iodoxol-1(3H)-yl acetate

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
With cesium fluoride In acetonitrile at 23℃; for 16h; Inert atmosphere; Darkness;	77%
With cesium fluoride In acetonitrile at 20℃; for 16h;	46%
With fluoride

: 69352-04-1
1-chloro-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 100 percent / acetonitrile / 15 h / 20 °C 2: 46 percent / CsF / acetonitrile / 16 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: potassium fluoride / acetonitrile / 12 h / 20 °C / Inert atmosphere 2: (trifluoromethyl)trimethylsilane / acetonitrile / 1 h / -10 °C / Inert atmosphere View Scheme

: 69352-05-2
2-(2-iodophenyl)propan-2-ol

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: tBuOCl 2: 100 percent / acetonitrile / 15 h / 20 °C 3: 46 percent / CsF / acetonitrile / 16 h / 20 °C View Scheme
Multi-step reaction with 3 steps 1: trichloroisocyanuric acid / acetonitrile / 0.17 h / 75 °C / Inert atmosphere; Reflux 2: potassium fluoride / acetonitrile / 12 h / 20 °C / Inert atmosphere 3: (trifluoromethyl)trimethylsilane / acetonitrile / 1 h / -10 °C / Inert atmosphere View Scheme

: 88-67-5
2-Iodobenzoic acid

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1.1: potassium carbonate / N,N-dimethyl-formamide / 14 h / 23 °C 2.1: diethyl ether / 3 h / 0 - 23 °C / Inert atmosphere 2.2: 1 h / 23 °C / Inert atmosphere 3.1: acetonitrile / 16 h / 23 °C / Inert atmosphere; Darkness 4.1: cesium fluoride / acetonitrile / 16 h / 23 °C / Inert atmosphere; Darkness View Scheme

: 610-97-9
o-iodo-methyl-benzoic acid

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1.1: diethyl ether / 3 h / 0 - 23 °C / Inert atmosphere 1.2: 1 h / 23 °C / Inert atmosphere 2.1: acetonitrile / 16 h / 23 °C / Inert atmosphere; Darkness 3.1: cesium fluoride / acetonitrile / 16 h / 23 °C / Inert atmosphere; Darkness View Scheme
Multi-step reaction with 4 steps 1: diethyl ether / -30 °C / Inert atmosphere 2: trichloroisocyanuric acid / acetonitrile / 0.17 h / 75 °C / Inert atmosphere; Reflux 3: potassium fluoride / acetonitrile / 12 h / 20 °C / Inert atmosphere 4: (trifluoromethyl)trimethylsilane / acetonitrile / 1 h / -10 °C / Inert atmosphere View Scheme
Multi-step reaction with 3 steps 1.1: magnesium / diethyl ether / 16.67 h / 0 - 20 °C / Inert atmosphere; Reflux 2.1: tert-butylhypochlorite / dichloromethane / 17 h / 0 °C / Darkness; Inert atmosphere 3.1: potassium acetate / acetonitrile / 1 h / 20 °C / Schlenk technique; Inert atmosphere 3.2: 19 h / -17 - 20 °C / Schlenk technique; Inert atmosphere View Scheme

: 1391728-13-4
1-fluoro-3,3-dimethyl-1,3-dihydro-1λ3-benzo[d][1,2]iodaoxole

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
With (trifluoromethyl)trimethylsilane In acetonitrile at -10℃; for 1h; Inert atmosphere;	29.7 g

: 134-20-3
2-carbomethoxyaniline

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
Multi-step reaction with 5 steps 1.1: sulfuric acid; sodium nitrite / water / 0 - 7 °C / Inert atmosphere 1.2: 1.58 h / -5 - 80 °C / Inert atmosphere 2.1: diethyl ether / -30 °C / Inert atmosphere 3.1: trichloroisocyanuric acid / acetonitrile / 0.17 h / 75 °C / Inert atmosphere; Reflux 4.1: potassium fluoride / acetonitrile / 12 h / 20 °C / Inert atmosphere 5.1: (trifluoromethyl)trimethylsilane / acetonitrile / 1 h / -10 °C / Inert atmosphere View Scheme

Yield

Multi-step reaction with 5 steps
1.1: sulfuric acid; sodium nitrite / water / 0 - 7 °C / Inert atmosphere
1.2: 1.58 h / -5 - 80 °C / Inert atmosphere
2.1: diethyl ether / -30 °C / Inert atmosphere
3.1: trichloroisocyanuric acid / acetonitrile / 0.17 h / 75 °C / Inert atmosphere; Reflux
4.1: potassium fluoride / acetonitrile / 12 h / 20 °C / Inert atmosphere
5.1: (trifluoromethyl)trimethylsilane / acetonitrile / 1 h / -10 °C / Inert atmosphere
View Scheme

: 69352-04-1
1-chloro-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole

: 75-46-7
trifluoromethan

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
Stage #1: trifluoromethan With C12H24KO6(1+)*C13H25B3N3(1-) In tetrahydrofuran at 0 - 20℃; Inert atmosphere; Stage #2: 1-chloro-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole In tetrahydrofuran at 20℃; for 0.166667h; Inert atmosphere;	78 %Spectr.
Stage #1: trifluoromethan With 18-crown-6 ether; benzyl potassium; hexamethylborazine In tetrahydrofuran at 0℃; for 1.33333h; Sealed tube; Stage #2: 1-chloro-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole In tetrahydrofuran at 0℃;

: 69352-04-1
1-chloro-1,3-dihydro-3,3-dimethyl-1,2-benziodoxole

: C4H8O*C12H24KO6(1+)*C7H18B3F3N3(1-)

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
In tetrahydrofuran at 25℃; for 0.166667h; Inert atmosphere; Glovebox;	78 %Spectr.

: 1391728-13-4
1-fluoro-3,3-dimethyl-1,3-dihydro-1λ3-benzo[d][1,2]iodaoxole

: 81290-20-2
(trifluoromethyl)trimethylsilane

: 887144-97-0
Togni's reagent

Conditions

Conditions	Yield
With tetrabutylammonium triphenyldifluorosilicate In acetonitrile at -20 - 20℃; for 1.5h;

: 887144-97-0
Togni's reagent

: 2564-83-2, 45842-10-2
2,2,6,6-Tetramethyl-1-piperidinyloxy free radical

: 621-07-8
N,N-dibenzylhydroxylamine

: 1335135-19-7
2,2,6,6-tetramethyl-1-(trifluoromethoxy)piperidine

Conditions

Conditions	Yield
Concentration; Inert atmosphere;	100%

...Expand

: 887144-97-0
Togni's reagent

: 868-59-7
L-cysteine ethyl ester hydrochloride

: (R)-ethyl 2-amino-3-((trifluoromethyl)thio)propanoate hydrochloride

Conditions

Conditions	Yield
In methanol	99%
In methanol at -78 - 20℃; for 1h; Schlenk technique; Inert atmosphere;	97%

: 887144-97-0
Togni's reagent

: C10H14N4O4S

: C11H13F3N4O4S

Conditions

Conditions	Yield
at -78℃;	99%

: 887144-97-0
Togni's reagent

: 18598-63-5
L-cysteine methyl ester hydrochloride

: methyl S-trifluoromethyl-(L)-cysteinate hydrochloride

Conditions

Conditions	Yield
at -78℃;	99%

: 887144-97-0
Togni's reagent

: 29264-40-2
5-pentenylbenzoate

: (E)-6,6,6-trifluorohex-4-en-1-yl benzoate

Conditions

Conditions	Yield
With 2-iodobenzoic acid potassium salt In N,N-dimethyl-formamide at 80℃; for 12h; Reagent/catalyst; Concentration; Solvent; Schlenk technique;	99%

: 887144-97-0
Togni's reagent

: 7677-24-9
trimethylsilyl cyanide

: 2039-86-3
3-bromostyrene

: C10H7BrF3N

Conditions

Conditions	Yield
With tetrakis(actonitrile)copper(I) hexafluorophosphate; {3aS-[2(3'aR,8'aS),3aα,8aα]}-2,2'-(cyclopropylidene)-bis{3a,8a-dihydro-8H-indeno[1,2-d]-oxazole} In acetonitrile at -20 - 20℃; for 1h; Sealed tube; Inert atmosphere; enantioselective reaction;	99%

...Expand

: 887144-97-0
Togni's reagent

: (E)-3-(3-methoxyphenyl)-1-phenylbut-3-en-1-one oxime

: (S)-5-(3-methoxyphenyl)-3-phenyl-5-(2,2,2-trifluoroethyl)-4,5-dihydroisoxazole

Conditions

Conditions	Yield
With C30H39N3O2S; copper diacetate In chloroform at -10℃; for 72h; Inert atmosphere; Schlenk technique; Sealed tube; Molecular sieve; enantioselective reaction;	99%

: 887144-97-0
Togni's reagent

: (E)-3-(naphthalen-2-yl)-1-phenylbut-3-en-1-one oxime

: (S)-5-(naphthalen-2-yl)-3-phenyl-5-(2,2,2-trifluoroethyl)-4,5-dihydroisoxazole

Conditions

Conditions	Yield
With C30H39N3O2S; copper diacetate In chloroform at -10℃; for 72h; Inert atmosphere; Schlenk technique; Sealed tube; Molecular sieve; enantioselective reaction;	99%

: 887144-97-0
Togni's reagent

: (E)-1-(3-bromophenyl)-3-phenylbut-3-en-1-one oxime

: (S)-3-(3-bromophenyl)-5-phenyl-5-(2,2,2-trifluoroethyl)-4,5-dihydroisoxazole

Conditions

Conditions	Yield
With C30H39N3O2S; copper diacetate In chloroform at -10℃; for 72h; Inert atmosphere; Schlenk technique; Sealed tube; Molecular sieve; enantioselective reaction;	99%

: 887144-97-0
Togni's reagent

: (E)-3-phenyl-1-(thiophen-3-yl)but-3-en-1-one oxime

: (S)-5-phenyl-3-(thiophen-3-yl)-5-(2,2,2-trifluoroethyl)-4,5-dihydroisoxazole

Conditions

Conditions	Yield
With C30H39N3O2S; copper diacetate In chloroform at -10℃; for 72h; Inert atmosphere; Schlenk technique; Sealed tube; Molecular sieve; enantioselective reaction;	99%

: 887144-97-0
Togni's reagent

: benzyl (S)-3-methyl-2-oxo-5-(trifluoromethoxy)indoline-1-carboxylate

: benzyl (R)-3-methyl-2-oxo-5-(trifluoromethoxy)-3-(trifluoromethyl)indoline-1-carboxylate

Conditions

Conditions	Yield
Stage #1: benzyl (S)-3-methyl-2-oxo-5-(trifluoromethoxy)indoline-1-carboxylate With C25H23N3O4; magnesium bromide ethyl etherate In dichloromethane at 20℃; for 0.0833333h; Schlenk technique; Inert atmosphere; Stage #2: Togni's reagent In dichloromethane at -78 - 20℃; for 19h; Schlenk technique; Inert atmosphere; enantioselective reaction;	99%

: 887144-97-0
Togni's reagent

: 292638-84-7
styrene

: 104-88-1
4-chlorobenzaldehyde

: 1-(4-chlorophenyl)-4,4,4-trifluoro-2-phenylbutan-1-one

Conditions

Conditions	Yield
With 3-(2,6-diisopropylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]thiazol-3-ium perchlorate; caesium carbonate In acetonitrile at 60℃; for 12h; Schlenk technique; Inert atmosphere;	99%
With 3-(2,6-diisopropylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]thiazol-3-ium perchlorate; caesium carbonate In dichloromethane; water at 25℃; for 6h; Catalytic behavior; Reagent/catalyst; Solvent; Schlenk technique; Inert atmosphere; Sealed tube;	84%

...Expand

: 887144-97-0
Togni's reagent

: 292638-84-7
styrene

: 1122-91-4
4-bromo-benzaldehyde

: 1-(4-bromophenyl)-4,4,4-trifluoro-2-phenylbutan-1-one

Conditions

Conditions	Yield
With 3-(2,6-diisopropylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]thiazol-3-ium perchlorate; caesium carbonate In acetonitrile at 60℃; for 12h; Schlenk technique; Inert atmosphere;	99%

...Expand

: 887144-97-0
Togni's reagent

: 7677-24-9
trimethylsilyl cyanide

: 18120-64-4
vinyl ester of phenylacetic acid

: C12H10F3NO2

Conditions

Conditions	Yield
With carbon tetrabromide; C43H38N2O2; copper (I) acetate In tert-butyl methyl ether at -20℃; for 12h; Inert atmosphere; Sealed tube; enantioselective reaction;	99%

...Expand

: 887144-97-0
Togni's reagent

: 79887-09-5
(4-butylphenyl)acetylene

: 1361988-15-9
1-butyl-4-(3,3,3-trifluoroprop-1-ynyl)benzene

Conditions

Conditions	Yield
With copper(l) iodide; 1,10-Phenanthroline; potassium hydrogencarbonate In dichloromethane at 20℃; for 18h; Inert atmosphere;	98%

: 887144-97-0
Togni's reagent

: 2039-82-9
1-bromo-4-ethenyl-benzene

: 7677-24-9
trimethylsilyl cyanide

: 2-(4-bromophenyl)-4,4,4-trifluorobutanenitrile

Conditions

Conditions	Yield
With (2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline)CuBr In dimethyl sulfoxide at 20℃; for 0.5h; Inert atmosphere;	98%

...Expand

: 887144-97-0
Togni's reagent

: 873-73-4
4-n-chlorophenylacetylene

: 2564-83-2, 45842-10-2
2,2,6,6-Tetramethyl-1-piperidinyloxy free radical

: 1335135-19-7
2,2,6,6-tetramethyl-1-(trifluoromethoxy)piperidine

Conditions

Conditions	Yield
With trimethylsilylazide; copper(I) bromide In methanol at 20℃; for 8h; Sealed tube; Inert atmosphere;	98%

...Expand

: 887144-97-0
Togni's reagent

: 135066-77-2
trimethyl((1-(octyloxy)vinyl)oxy)silane

: 116044-36-1
Octyl 3,3,3-trifluoropropanoate

Conditions

Conditions	Yield
With trimethylsilyl bis(trifluoromethanesulfonyl)imide In dichloromethane at -78 - 20℃; for 19h; Inert atmosphere;	98%

: 887144-97-0
Togni's reagent

: 1866-39-3
trans-p-methylcinnamic acid

: 80959-78-0, 78622-56-7
(E)-1-methyl-4-(3,3,3-trifluoroprop-1-en-1-yl)benzene

Conditions

Conditions	Yield
In N,N-dimethyl-formamide at 120℃; for 24h; Reagent/catalyst; Solvent; Temperature; stereoselective reaction;	98%

: 887144-97-0
Togni's reagent

: 2564-83-2, 45842-10-2
2,2,6,6-Tetramethyl-1-piperidinyloxy free radical

: 1335135-19-7
2,2,6,6-tetramethyl-1-(trifluoromethoxy)piperidine

Conditions

Conditions	Yield
With tetrakis(actonitrile)copper(I) hexafluorophosphate; trimethylsilyl cyanide; (3aR,3a'R,8aS,8a'S)-2,2'-(cyclopentane-1,1-diyl)bis(3a,8a-dihydro-8H-indeno[1,2-d]oxazole); 2-(pent-4-en-2-yn-1-yl)isoindoline-1,3-dione In acetonitrile at -15 - 20℃; for 2.5h; Reagent/catalyst; Temperature; Sealed tube; Inert atmosphere;	98%
With diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate In acetone at 25℃; for 24h;	80%
With α-phenylacrylanilide; copper(II) bis(trifluoromethanesulfonate); p-tert-butylphenylboronic acid; (4S,4'S)-2,2'-(1,3-diphenylpropane-2,2-diyl)-bis(4-benzyl-4,5-dihydrooxazole) In methanol at 0℃; for 72h; Inert atmosphere; Sealed tube;	79%

: 887144-97-0
Togni's reagent

: 6-benzyl-1-methyl-7-((trimethylsilyl)oxy)-2,3,4,5-tetrahydro-1H-azepine

: 3-benzyl-1-methyl-3-(trifluoromethyl)azepan-2-one

Conditions

Conditions	Yield
With trimethylsilyl bis(trifluoromethanesulfonyl)imide In dichloromethane at -78 - 20℃; for 19h; Schlenk technique; Inert atmosphere;	98%

: 887144-97-0
Togni's reagent

: 32294-60-3
diphenyl ditelluride

: 1-iodo-3,3-dimethyl-1-phenyl-1,3-dihydro-2,1λ4-benzoxatellurole

Conditions

Conditions	Yield
at 80℃; Sealed tube; Inert atmosphere;	98%

: 887144-97-0
Togni's reagent

: 1484-13-5
9-vinyl-9H-carbazole

: 104-88-1
4-chlorobenzaldehyde

: C22H15ClF3NO

Conditions

Conditions	Yield
With 3-(2,6-diisopropylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]thiazol-3-ium perchlorate; caesium carbonate In dichloromethane; water at 25℃; for 12h; Schlenk technique; Inert atmosphere; Sealed tube;	98%

...Expand

: 887144-97-0
Togni's reagent

: 3485-84-5
N-vinylphthalimide

: 7677-24-9
trimethylsilyl cyanide

: C12H7F3N2O2

Conditions

Conditions	Yield
With carbon tetrabromide; C43H38N2O2; copper (I) acetate In tert-butyl methyl ether at -20℃; for 12h; Inert atmosphere; Sealed tube; enantioselective reaction;	98%

...Expand

: 887144-97-0
Togni's reagent

: 88-12-0
1-ethenyl-2-pyrrolidinone

: 7677-24-9
trimethylsilyl cyanide

A: C8H9F3N2O

B: C8H9F3N2O

Conditions

Conditions	Yield
With carbon tetrabromide; C43H38N2O2; copper (I) acetate In tert-butyl methyl ether at -20℃; for 12h; Inert atmosphere; Sealed tube; Overall yield = 96 percent; Overall yield = 39.5 mg; enantioselective reaction;	A 98% B n/a

...Expand

: 887144-97-0
Togni's reagent

: 7677-24-9
trimethylsilyl cyanide

: 769-78-8
vinyl benzoate

: C11H8F3NO2

Conditions

Conditions	Yield
With carbon tetrabromide; C43H38N2O2; copper (I) acetate In tert-butyl methyl ether at -20℃; for 12h; Catalytic behavior; Reagent/catalyst; Inert atmosphere; Sealed tube; enantioselective reaction;	98%

...Expand

: 887144-97-0
Togni's reagent

: 7677-24-9
trimethylsilyl cyanide

: 13313-25-2
N-benzoylethyleneimine

: C11H9F3N2O

Conditions

Conditions	Yield
With carbon tetrabromide; C25H26N2O2; copper (I) acetate In tert-butyl methyl ether at -20℃; for 12h; Catalytic behavior; Reagent/catalyst; Temperature; Solvent; Inert atmosphere; Sealed tube; enantioselective reaction;	98%

...Expand

: 887144-97-0
Togni's reagent

: ethyl (E)-2-(2,2-diphenylhydrazono)acetate

: ethyl (E)-2-(2,2-diphenylhydrazono)-3,3,3-trifluoropropanoate

Conditions

Conditions	Yield
With copper(l) chloride In chloroform at 25℃; for 2h; Inert atmosphere; Sealed tube;	97%

: 887144-97-0
Togni's reagent

: 5-benzyl-1-methyl-6-((trimethylsilyl)oxy)-1,2,3,4-tetrahydropyridine

: 3-benzyl-1-methyl-3-(trifluoromethyl)piperidin-2-one

Conditions

Conditions	Yield
With trimethylsilyl bis(trifluoromethanesulfonyl)imide In dichloromethane at -78 - 20℃; for 19h; Reagent/catalyst; Schlenk technique; Inert atmosphere;	97%

: 887144-97-0
Togni's reagent

: tert-butyl (R)-3-(4-fluorobenzyl)-2-oxo-3-(trifluoromethyl)indoline-1-carboxylate

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-(4-fluorobenzyl)-2-oxoindoline-1-carboxylate With magnesium bromide ethyl etherate; {3aS-[2(3'aR,9'bS),3aα,9bα]}-2,2'-(2,6-pyridinediyl)bis[3a,4,5,9b-tetrahydronaphth[1,2-d]oxazole] In dichloromethane at 20℃; for 0.0833333h; Schlenk technique; Inert atmosphere; Stage #2: Togni's reagent In dichloromethane at -78 - 20℃; for 19h; Catalytic behavior; Reagent/catalyst; Schlenk technique; Inert atmosphere; enantioselective reaction;	97%

Yield

Stage #1: tert-butyl 3-(4-fluorobenzyl)-2-oxoindoline-1-carboxylate With magnesium bromide ethyl etherate; {3aS-[2(3'aR*,9'bS*),3aα,9bα]}-2,2'-(2,6-pyridinediyl)bis[3a,4,5,9b-tetrahydronaphth[1,2-d]oxazole] In dichloromethane at 20℃; for 0.0833333h; Schlenk technique; Inert atmosphere;
Stage #2: Togni's reagent In dichloromethane at -78 - 20℃; for 19h; Catalytic behavior; Reagent/catalyst; Schlenk technique; Inert atmosphere; enantioselective reaction;

97%

3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole Specification

The 3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole with cas registry number of 887144-97-0, whose systematic name is 3,3-dimethyl-1-(trifluoromethyl)-1,3-dihydro-1lambda~3~,2-benziodoxole. And it is also named 1,3-Dihydro-3,3-dimethyl-1-(trifluoromethyl)-1,2-benziodoxole, Tognis Reagent.

When you are using this chemical, please be cautious about it as the following:
The 3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES:FC(F)(F)I2OC(c1ccccc12)(C)C;
(2)InChI:InChI=1/C10H10F3IO/c1-9(2)7-5-3-4-6-8(7)14(15-9)10(11,12)13/h3-6H,1-2H3;
(3)InChIKey:HVAPLSNCVYXFDQ-UHFFFAOYAK;
(4)Std. InChI:InChI=1S/C10H10F3IO/c1-9(2)7-5-3-4-6-8(7)14(15-9)10(11,12)13/h3-6H,1-2H3;
(5)Std. InChIKey:HVAPLSNCVYXFDQ-UHFFFAOYSA-N.

Product Name

1,3-Dihydro-3,3-dimethyl-1-(trifluoromethyl)-1,2-benziodoxole, Tognis Reagent

Synthetic route

3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole Specification

Related Products

Hot Products

Hazard Codes	Xi
Risk Statements	36/37/38
Safety Statements	26-36/37