(S)-2-methylbutyl bromide
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
With sodium iodide In acetone 1) 1 h, 25 deg C, 2) 3 h, reflux; | 91% |
(S)-2-methylbutyl tosylate
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
With sodium iodide In N,N-dimethyl-formamide at 60℃; for 1h; | 89% |
With sodium iodide In acetone for 6h; Heating; | 75% |
With iodine; magnesium In diethyl ether at 20℃; for 13h; | 71% |
(2S)-2-methyl-1-butanol
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
With 1H-imidazole; iodine; triphenylphosphine In dichloromethane at 20℃; for 2h; Inert atmosphere; | 83% |
With 1H-imidazole; iodine; triphenylphosphine In dichloromethane at 20℃; for 5h; | 79% |
With triphenyl phosphite; iodine In dichloromethane | 77% |
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
With sodium hydroxide; iodine In tetrahydrofuran; water |
(2S)-2-methyl-1-butanol
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
With diethyl ether; magnesium iodide |
(S)-2-Methylbutyl tetrahydropyranyl ether
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: p-TsOH*H2O / methanol / 4 h / Heating 2: pyridine / 12 h / 0 - 5 °C 3: 75 percent / NaI / acetone / 6 h / Heating View Scheme | |
Multi-step reaction with 3 steps 1: 96 percent / pyridinium p-toluenesulfonate / ethanol / 12 h / Ambient temperature 2: 98 percent / pyridine / 12 h / 0 - 5 °C 3: 66 percent / sodium iodide / acetone / 12 h / Heating View Scheme |
(S)-2-methyl-1-butyl methanesulfonate
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
With sodium iodide In acetone Finkelstein reaction; Reflux; |
(S)-1-iodo-2-methyl-butane
1-bromo-2-(methoxymethoxy)benzene
(S)-1-(methoxymethoxy)-2-(2-methylbutyl)benzene
Conditions | Yield |
---|---|
Stage #1: 1-bromo-2-(methoxymethoxy)benzene With magnesium In tetrahydrofuran Kumada coupling reaction; Inert atmosphere; Reflux; Stage #2: (S)-1-iodo-2-methyl-butane With iron(III)-acetylacetonate; N,N,N,N,-tetramethylethylenediamine; hexamethylenetetramine In tetrahydrofuran at 0℃; for 1.5h; Kumada coupling reaction; | 98% |
Stage #1: (S)-1-iodo-2-methyl-butane With magnesium In tetrahydrofuran for 1h; Inert atmosphere; Heating; Stage #2: 1-bromo-2-(methoxymethoxy)benzene With N,N,N,N,N,N-hexamethylphosphoric triamide; iron(III)-acetylacetonate; N,N,N,N,-tetramethylethylenediamine In tetrahydrofuran at 0℃; for 1.5h; Kumada coupling reaction; Inert atmosphere; | 98% |
(S)-1-iodo-2-methyl-butane
((S)-9-Methyl-tridecane-1-sulfonyl)-benzene
((3S,13S)-3,13-Dimethyl-heptadecane-5-sulfonyl)-benzene
Conditions | Yield |
---|---|
With n-butyllithium In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; hexane 1.) -78 deg C to -30 deg C, 2.) -78 deg C to r.t., 5 h; | 95% |
(S)-1-iodo-2-methyl-butane
N-((R)-2-Hydroxy-1-methyl-2-phenyl-ethyl)-N-methyl-propionamide
(2S,4S)-N-[(1'R,2'R)-2'-hydroxy-1'-methyl-2'-phenylethyl]-N-methyl-2,4-dimethylhexanamide
Conditions | Yield |
---|---|
With n-butyllithium; diisopropylamine; lithium chloride In tetrahydrofuran at 23℃; for 18h; | 94% |
(S)-1-iodo-2-methyl-butane
N-[(1S,2S)-2-hydroxy-1-methyl-2-phenylethyl]-N-methylpropionamide
(2R,4S)-N-((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)-N,2,4-trimethylhexanamide
Conditions | Yield |
---|---|
With n-butyllithium; diisopropylamine; lithium chloride In tetrahydrofuran at 23℃; for 20h; | 94% |
Stage #1: N-[(1S,2S)-2-hydroxy-1-methyl-2-phenylethyl]-N-methylpropionamide With n-butyllithium; lithium chloride; lithium diisopropyl amide In tetrahydrofuran; hexane at -78℃; for 1h; Inert atmosphere; Stage #2: (S)-1-iodo-2-methyl-butane In tetrahydrofuran; hexane at 0 - 20℃; for 18h; Inert atmosphere; | 74% |
(S)-1-iodo-2-methyl-butane
(R)-Citronellal
Conditions | Yield |
---|---|
Stage #1: (S)-1-iodo-2-methyl-butane With tert.-butyl lithium In diethyl ether; pentane at -78 - 20℃; for 0.333333h; Inert atmosphere; Stage #2: (R)-Citronellal In diethyl ether; pentane at -78℃; for 1.5h; Inert atmosphere; Stage #3: With hydrogenchloride; ammonium chloride In diethyl ether; water; pentane Cooling with ice; | 86% |
(S)-1-iodo-2-methyl-butane
(S)-Citronellal
(3S,5RS,7S)-3,7,11-trimethyl-10-dodecen-5-ol
Conditions | Yield |
---|---|
Stage #1: (S)-1-iodo-2-methyl-butane With tert.-butyl lithium In diethyl ether; pentane at -78 - 20℃; for 0.333333h; Inert atmosphere; Stage #2: (S)-Citronellal In diethyl ether; pentane at -78℃; for 1.5h; Inert atmosphere; Stage #3: With hydrogenchloride; ammonium chloride In diethyl ether; water; pentane Cooling with ice; | 84% |
(S)-1-iodo-2-methyl-butane
triphenylphosphine
(S)-(2-methyl-butyl)triphenylphosphonium iodide
Conditions | Yield |
---|---|
In toluene at 105℃; for 63h; Inert atmosphere; | 82% |
2-methyl-1,3-dithian
(S)-1-iodo-2-methyl-butane
(S)-(+)-2-(2-methylbutyl)-2-methyl-1,3-dithiane
Conditions | Yield |
---|---|
With n-butyllithium 1.) hexane, THF, -70 degC to 0 degC, 3 h, 2a.) THF, -78 degC, 1 h, 2b.) room temp., 12 h; | 81% |
(S)-1-iodo-2-methyl-butane
(2RS,4S)-(+)-2,4-Dimethylhexansaeure
Conditions | Yield |
---|---|
With N,N,N,N,N,N-hexamethylphosphoric triamide In tetrahydrofuran at -15℃; for 2h; | 80% |
phenylacetic acid
(S)-1-iodo-2-methyl-butane
(2R,4S)-4-methyl-2-phenylhexanoic acid
Conditions | Yield |
---|---|
Stage #1: phenylacetic acid With n-butyllithium; C29H44N4 In tetrahydrofuran; hexanes at 0℃; Inert atmosphere; Stage #2: (S)-1-iodo-2-methyl-butane In tetrahydrofuran; hexanes at -78℃; for 10h; Inert atmosphere; optical yield given as %de; diastereoselective reaction; | 79% |
(S)-1-iodo-2-methyl-butane
(1R,2R)-(-)-pseudoephedrinepropionamide
(2S,4S)-N-[(1'R,2'R)-2'-hydroxy-1'-methyl-2'-phenylethyl]-N-methyl-2,4-dimethylhexanamide
Conditions | Yield |
---|---|
Stage #1: (1R,2R)-(-)-pseudoephedrinepropionamide With n-butyllithium; lithium chloride; lithium diisopropyl amide In tetrahydrofuran; hexane at -78℃; for 1h; Inert atmosphere; Stage #2: (S)-1-iodo-2-methyl-butane In tetrahydrofuran; hexane at 0 - 20℃; for 18h; Inert atmosphere; | 79% |
Stage #1: (1R,2R)-(-)-pseudoephedrinepropionamide With n-butyllithium; diisopropylamine; lithium chloride In tetrahydrofuran; hexane at -78 - 25℃; for 1.33333h; Stage #2: (S)-1-iodo-2-methyl-butane In tetrahydrofuran; hexane at 0 - 25℃; for 24h; |
(S)-1-iodo-2-methyl-butane
diethyl malonate
diethyl S-(+)-2-methyl-1-butyl malonate
Conditions | Yield |
---|---|
With ethanol; sodium In ethanol at 0 - 20℃; | 76.5% |
(S)-1-iodo-2-methyl-butane
((R)-9-Methyl-tridecane-1-sulfonyl)-benzene
((3S,13R)-3,13-Dimethyl-heptadecane-5-sulfonyl)-benzene
Conditions | Yield |
---|---|
With n-butyllithium In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; hexane 1.) -78 deg C to -30 deg C, 2.) -78 deg C to r.t., 5 h; | 72% |
(S)-1-iodo-2-methyl-butane
2,2':6',2''-Terpyridin-4'(1'H)-one
C20H21N3O
Conditions | Yield |
---|---|
With potassium carbonate In N,N-dimethyl-formamide at 100℃; for 12h; Inert atmosphere; | 71% |
3-hydroxyquinoline
(S)-1-iodo-2-methyl-butane
(5)-3-(2-methylbutyloxy)quinoline
Conditions | Yield |
---|---|
With potassium carbonate In dimethyl sulfoxide at 80℃; for 4h; | 68% |
phenylacetic acid
(S)-1-iodo-2-methyl-butane
(2S,4S)-4-methyl-2-phenylhexanoic acid
Conditions | Yield |
---|---|
Stage #1: phenylacetic acid With n-butyllithium; N1,N3-bis((R)-1-phenyl-2-(piperidin-1-yl)ethyl)propane-1,3-diamine In tetrahydrofuran; hexanes at 0℃; Inert atmosphere; Stage #2: (S)-1-iodo-2-methyl-butane In tetrahydrofuran; hexanes at -78℃; for 10h; Inert atmosphere; optical yield given as %de; diastereoselective reaction; | 67% |
(S)-1-iodo-2-methyl-butane
(5,10,15,20-tetraphenyl-2-aza-21-carbaporphyrinato)nickel(II)
Conditions | Yield |
---|---|
With potassium carbonate In ethanol; dichloromethane under N2; mixt. of Ni complex and S-2-(methyliodo)butane (7 equiv.) in CH2Cl2-EtOH contg. suspn. of K2CO3 refluxed for 3 h; solvent evapd. under reduced pressure; dissolved in CH2Cl2; chromd. (silica gel, CH2Cl2); second brown-reddish band collected; crystd. from CH2Cl2-hexane; mixt. of two diastereomers (1:1) obtained; | 66% |
(S)-1-iodo-2-methyl-butane
diethyl 5,5′,6,6′,9,9′,10,10′-octamethoxy-2H,2′H-[1,1′-bidibenzo[e,g]isoindole]-3,3′-dicarboxylate
diethyl 5,5′,6,6′,9,9′,10,10′-octamethoxy-2,2′-bis((S)-2-methylbutyl)-2H,2′H-[1,1′-bidibenzo[e,g]isoindole]-3,3′-dicarboxylate
Conditions | Yield |
---|---|
Stage #1: diethyl 5,5′,6,6′,9,9′,10,10′-octamethoxy-2H,2′H-[1,1′-bidibenzo[e,g]isoindole]-3,3′-dicarboxylate With 18-crown-6 ether; potassium carbonate In tetrahydrofuran for 0.5h; Inert atmosphere; Stage #2: (S)-1-iodo-2-methyl-butane In tetrahydrofuran at 90℃; for 48h; Inert atmosphere; | 64% |
(S)-1-iodo-2-methyl-butane
(-)-(S)-2-methyl-1-nitrobutane
Conditions | Yield |
---|---|
With silver(I) nitrite In diethyl ether 1.) 0 deg C, 24 h; 2.) RT, 48 h; | 62% |
(S)-1-iodo-2-methyl-butane
(S)-1,3-benzodithiole-1-oxide
2-<(S)-2'-methylbutyl>-2-<(S)-2"-methylbutyl>-1,3-benzodithiole 1-oxide
Conditions | Yield |
---|---|
With potassium hexamethylsilazane In tetrahydrofuran; toluene for 72h; Ambient temperature; | 54% |
(S)-1-iodo-2-methyl-butane
benzo-1,3-dithiolane-1-oxide
A
2-<(S)-2'-methylbutyl>-2-<(S)-2"-methylbutyl>-1,3-benzodithiole 1-oxide
B
2-<(S)-2'-methylbutyl>-2-<(S)-2"-methylbutyl>-1,3-benzodithiole 1-oxide
Conditions | Yield |
---|---|
With potassium hexamethylsilazane In tetrahydrofuran; toluene Ambient temperature; | A 47% B 40% |
di(pyridin-2-yl)amine
(S)-1-iodo-2-methyl-butane
N-(S)-2-methylbutyldipyridylamine
Conditions | Yield |
---|---|
Stage #1: di(pyridin-2-yl)amine With sodium hydride In dimethyl sulfoxide at 60℃; for 12h; Stage #2: (S)-1-iodo-2-methyl-butane In dimethyl sulfoxide at 60℃; for 24h; | 34% |
bis(acetonitrile)dichloroplatinum(II)
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
Stage #1: (S)-1-iodo-2-methyl-butane With potassium; magnesium chloride In tetrahydrofuran for 3h; Stage #2: diiodo-tetra-tert-butylhexaphosphapentaprismane In tetrahydrofuran at -80℃; Stage #3: bis(acetonitrile)dichloroplatinum(II) In tetrahydrofuran for 28h; diastereoselective reaction; | 31% |
(S)-1-iodo-2-methyl-butane
benzo-1,3-dithiolane-1-oxide
A
2-(2'-methylbutyl)-1,3-benzodithiole 1-oxide
B
2-(2'-methylbutyl)-1,3-benzodithiole 1-oxide
C
2-(2'-methylbutyl)-1,3-benzodithiole 1-oxide
D
2-(2'-methylbutyl)-1,3-benzodithiole 1-oxide
Conditions | Yield |
---|---|
With potassium hexamethylsilazane In tetrahydrofuran; toluene for 72h; Ambient temperature; | A 30% B 8% C 8% D 24% |
(S)-1-iodo-2-methyl-butane
2,5-dimethylbutyl-3,6-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-1,4-dione
Conditions | Yield |
---|---|
Stage #1: 3,6-dithiophen-2-yl-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione With potassium carbonate In N,N-dimethyl-formamide at 120℃; Inert atmosphere; Stage #2: (S)-1-iodo-2-methyl-butane In N,N-dimethyl-formamide at 125℃; for 15h; | 30% |
3,6-dibromo-9H-carbazole
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
With potassium carbonate In N,N-dimethyl-formamide at 100℃; for 24h; | 26% |
dichloro(1,5-cyclooctadiene)palladium(II)
(S)-1-iodo-2-methyl-butane
Conditions | Yield |
---|---|
Stage #1: (S)-1-iodo-2-methyl-butane With potassium; magnesium chloride In tetrahydrofuran for 3h; Stage #2: diiodo-tetra-tert-butylhexaphosphapentaprismane In tetrahydrofuran at -80℃; Stage #3: dichloro(1,5-cyclooctadiene)palladium(II) In tetrahydrofuran for 20.5h; diastereoselective reaction; | 23% |
The Butane,1-iodo-2-methyl-, (2S)-, with the CAS registry number 29394-58-9, has the systematic name of (2S)-1-iodo-2-methylbutane. It is a kind of clear colorless to yellow liquid, and belongs to the following product categories: Chiral Building Blocks; Halogenated Hydrocarbons; Organic Building Blocks. The molecular formula of the chemical is C5H11I.
The characteristics of Butane,1-iodo-2-methyl-, (2S)- are as followings: (1)ACD/LogP: 3.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.44; (4)ACD/LogD (pH 7.4): 3.44; (5)ACD/BCF (pH 5.5): 241.6; (6)ACD/BCF (pH 7.4): 241.6; (7)ACD/KOC (pH 5.5): 1767.8; (8)ACD/KOC (pH 7.4): 1767.8; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: Å2; (13)Index of Refraction: 1.497; (14)Molar Refractivity: 38.14 cm3; (15)Molar Volume: 130.2 cm3; (16)Polarizability: 15.12×10-24cm3; (17)Surface Tension: 29 dyne/cm; (18)Density: 1.52 g/cm3; (19)Flash Point: 42.8 °C; (20)Enthalpy of Vaporization: 36.78 kJ/mol; (21)Boiling Point: 146.6 °C at 760 mmHg; (22)Vapour Pressure: 5.82 mmHg at 25°C.
You should be cautious while dealing with this chemical. It is a kind of flammable chemical which irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Keep away from sources of ignition - No smoking; Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: IC[C@@H](C)CC
(2)InChI: InChI=1/C5H11I/c1-3-5(2)4-6/h5H,3-4H2,1-2H3/t5-/m0/s1
(3)InChIKey: RHBHXHXNWHTGSO-YFKPBYRVBR
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View