Conditions | Yield |
---|---|
With bismuth(III) chloride In tetrachloromethane at 25℃; for 0.0833333h; | 100% |
With phenylphosphorus tetrachloride In chloroform at 50℃; for 12h; | 97% |
With acetic acid; calcium chloride at 55℃; for 8h; Reagent/catalyst; Temperature; | 96.2% |
Conditions | Yield |
---|---|
In chloroform-d1 at 100℃; for 4h; Sealed tube; Inert atmosphere; | A 93% B 100% |
pivaloyl chloride
A
tertiary butyl chloride
B
1-chloro-2,2-dimethylcyclopropane
Conditions | Yield |
---|---|
With pyrographite at -196.16℃; under 1E-05 - 0.0001 Torr; | A 95% B 5% |
Conditions | Yield |
---|---|
In chloroform-d1 at 120℃; for 0.5h; | A 92% B 76% C 13% |
Conditions | Yield |
---|---|
With thionyl chloride In dichloromethane for 1h; Heating; | A 92% B 75% |
With thionyl chloride In dichloromethane for 1h; Mechanism; Product distribution; Heating; | A 92% B 75% |
Conditions | Yield |
---|---|
With tin(IV) chloride for 3h; | 85% |
With chloride at 30.9℃; under 760 Torr; Thermodynamic data; Equilibrium constant; ΔH0; | |
With bismuth(III) chloride In 1,2-dichloro-ethane at 25℃; for 0.833333h; Yield given; |
pivaloyl chloride
A
2-<(trichloromethyl)thio>pyridine
B
tertiary butyl chloride
Conditions | Yield |
---|---|
With tetrachloromethane; 2-mercaptopyridine-1-oxide sodium salt; dmap at 76℃; for 2h; | A n/a B 82% |
acetyl chloride
tert-butyl alcohol
A
acetic acid tert-butyl ester
B
tertiary butyl chloride
Conditions | Yield |
---|---|
In dichloromethane 1.) 0 deg C, 2.) room temperature, 1 h; Yield given; | A n/a B 81% |
In dichloromethane for 1h; Rate constant; Mechanism; Ambient temperature; further solvents and times; further alcohols; |
tert-butyl alcohol
A
acetic acid tert-butyl ester
B
tertiary butyl chloride
Conditions | Yield |
---|---|
With acetyl chloride In dichloromethane for 1h; 0 deg C -> room temperature; Yields of byproduct given; | A n/a B 81% |
Conditions | Yield |
---|---|
With dichloromethane; antimony pentafluoride 1.) -78 deg C, 2 h, 2.) RT, 24 h; | 76% |
at -15℃; Photochlorierung; | |
at 54℃; bei der photochemischen Chlorierung; | |
at 450 - 500℃; bei der thermischen Chlorierung; |
chloro-diisopropyl-amine
tert-butylisonitrile
A
tertiary butyl chloride
B
diisopropylcyanamide
Conditions | Yield |
---|---|
With zinc(II) chloride In dichloromethane at 23℃; for 12h; | A n/a B 75% |
tetrachloromethane
tert-butyl alcohol
A
tertiary butyl chloride
B
4,4,4-Trichloro-2-methyl-1-butene
Conditions | Yield |
---|---|
hexacarbonyl molybdenum at 150℃; for 3h; | A 66% B n/a |
Conditions | Yield |
---|---|
With bismuth(III) chloride In tetrachloromethane at 25℃; for 0.0833333h; | 100% |
With phenylphosphorus tetrachloride In chloroform at 50℃; for 12h; | 97% |
With acetic acid; calcium chloride at 55℃; for 8h; Reagent/catalyst; Temperature; | 96.2% |
Conditions | Yield |
---|---|
In chloroform-d1 at 100℃; for 4h; Sealed tube; Inert atmosphere; | A 93% B 100% |
pivaloyl chloride
A
tertiary butyl chloride
B
1-chloro-2,2-dimethylcyclopropane
Conditions | Yield |
---|---|
With pyrographite at -196.16℃; under 1E-05 - 0.0001 Torr; | A 95% B 5% |
Conditions | Yield |
---|---|
In chloroform-d1 at 120℃; for 0.5h; | A 92% B 76% C 13% |
Conditions | Yield |
---|---|
With thionyl chloride In dichloromethane for 1h; Heating; | A 92% B 75% |
With thionyl chloride In dichloromethane for 1h; Mechanism; Product distribution; Heating; | A 92% B 75% |
Conditions | Yield |
---|---|
With tin(IV) chloride for 3h; | 85% |
With chloride at 30.9℃; under 760 Torr; Thermodynamic data; Equilibrium constant; ΔH0; | |
With bismuth(III) chloride In 1,2-dichloro-ethane at 25℃; for 0.833333h; Yield given; |
pivaloyl chloride
A
2-<(trichloromethyl)thio>pyridine
B
tertiary butyl chloride
Conditions | Yield |
---|---|
With tetrachloromethane; 2-mercaptopyridine-1-oxide sodium salt; dmap at 76℃; for 2h; | A n/a B 82% |
acetyl chloride
tert-butyl alcohol
A
acetic acid tert-butyl ester
B
tertiary butyl chloride
Conditions | Yield |
---|---|
In dichloromethane 1.) 0 deg C, 2.) room temperature, 1 h; Yield given; | A n/a B 81% |
In dichloromethane for 1h; Rate constant; Mechanism; Ambient temperature; further solvents and times; further alcohols; |
tert-butyl alcohol
A
acetic acid tert-butyl ester
B
tertiary butyl chloride
Conditions | Yield |
---|---|
With acetyl chloride In dichloromethane for 1h; 0 deg C -> room temperature; Yields of byproduct given; | A n/a B 81% |
Conditions | Yield |
---|---|
With dichloromethane; antimony pentafluoride 1.) -78 deg C, 2 h, 2.) RT, 24 h; | 76% |
at -15℃; Photochlorierung; | |
at 54℃; bei der photochemischen Chlorierung; | |
at 450 - 500℃; bei der thermischen Chlorierung; |
chloro-diisopropyl-amine
tert-butylisonitrile
A
tertiary butyl chloride
B
diisopropylcyanamide
Conditions | Yield |
---|---|
With zinc(II) chloride In dichloromethane at 23℃; for 12h; | A n/a B 75% |
tetrachloromethane
tert-butyl alcohol
A
tertiary butyl chloride
B
4,4,4-Trichloro-2-methyl-1-butene
Conditions | Yield |
---|---|
hexacarbonyl molybdenum at 150℃; for 3h; | A 66% B n/a |
2,4,6-tri-tert-butyl-7,8,9-dithiazabicyclo<4.3.0>nona-1(9),2,4-triene
A
tertiary butyl chloride
B
2,4,6-tri-tert-butylaniline hydrochloride
Conditions | Yield |
---|---|
With phosphorus pentachloride In dichloromethane at 20℃; for 12h; | A n/a B n/a C 64% |
Conditions | Yield |
---|---|
With acetyl chloride In dichloromethane for 24h; Heating; | 58% |
With chloro-trimethyl-silane; Iodine monochloride for 0.1h; Ambient temperature; | 75 % Spectr. |
With chloro-trimethyl-silane; bismuth(III) chloride In neat (no solvent) for 0.166667h; Ambient temperature; | 95 % Chromat. |
tert-butylhypochlorite
phosphorus trichloride
A
tertiary butyl chloride
B
trichlorophosphate
Conditions | Yield |
---|---|
at 10 - 15℃; | A 2 g B 57% |
tert.-butylhydroperoxide
tert-butylsulfinyl chloride
A
tertiary butyl chloride
B
tert-butylsulfonyl chloride
C
di-tert-butyl thiosulfonate
D
acetone
F
tert-butyl alcohol
Conditions | Yield |
---|---|
With pyridine In chloroform at 20℃; for 2h; Mechanism; | A 8% B 8% C 36% D 20% E n/a F 55% |
tetrachloromethane
A
2-methyl-1,2-benzisothiazole-3(2H)-one
B
tertiary butyl chloride
C
1,1,1,3-tetrachloro-3-methylbutane
Conditions | Yield |
---|---|
at 78℃; Product distribution; further study of 2-MeS-C6H4-CON(Me)CSNMe2; | A 55% B 20% C 28% |
S-tert-butyl thioacetate
A
tertiary butyl chloride
B
1,1-dimethylethanesulfenyl chloride
C
acetyl chloride
Conditions | Yield |
---|---|
With sulfuryl dichloride In tetrachloromethane for 1h; Ambient temperature; | A 50% B 50% C n/a |
Trifluoromethylsulfenyl chloride
Isobutane
B
tertiary butyl chloride
C
2-methyl-2-[(trifluoromethyl)thio]propane
D
Bis(trifluoromethyl)disulfid
E
isobutyryl chloride
Conditions | Yield |
---|---|
byproducts: HCl; Irradiation (UV/VIS); | A 12% B 33% C 24% D 47% E 1% |
byproducts: HCl; Irradiation (UV/VIS); | A 12% B 33% C 24% D 47% E 1% |
bis(trifluoromethyl)phosphinic chloride
tert-butyl alcohol
tertiary butyl chloride
Conditions | Yield |
---|---|
sealed Pyrex tube, room temp., 3 d; | 39% |
tert.-butylhydroperoxide
tert-butylsulfinyl chloride
A
tertiary butyl chloride
B
tert-butylsulfonyl chloride
C
di-tert-butyl thiosulfonate
Conditions | Yield |
---|---|
With pyridine In chloroform at 20℃; for 2h; Further byproducts given; | A 8% B 8% C 36% D n/a |
3-(chlorosulfinyl)propanoyl chloride
A
tertiary butyl chloride
B
3-sulfinopropionic acid
C
3-Sulfino-propionic acid tert-butyl ester
D
isobutene
Conditions | Yield |
---|---|
With tert-butyl alcohol In diethyl ether for 3h; | A n/a B 25.4% C n/a D n/a |
3-(chlorosulfinyl)propanoyl chloride
tert-butyl alcohol
A
tertiary butyl chloride
B
3-sulfinopropionic acid
C
3-Sulfino-propionic acid tert-butyl ester
D
isobutene
Conditions | Yield |
---|---|
In diethyl ether for 3h; | A n/a B 25.4% C n/a D n/a |
di-tert-butyl nitroxide
A
tertiary butyl chloride
B
t-butylnitrite
C
di-tert-butylhydroxylammonium chloride
D
isobutene
Conditions | Yield |
---|---|
In tetrachloromethane for 0.25h; Irradiation; Further byproducts given; | A n/a B n/a C 14% D n/a |
Isobutane
A
tertiary butyl chloride
B
isobutyryl chloride
C
tert-butyl alcohol
Conditions | Yield |
---|---|
With 5,10,15,20-tetraphenyl-21 H,23-H-porphine manganese(III)chloride; iodosylbenzene In water; chlorobenzene for 12h; | A 9% B 1% C 2% |
With IVTPP(OIPh)>2O In chlorobenzene at 25℃; for 1h; Product distribution; Mechanism; further reagents (2,2-diphenyl-1-picrylhydrazyl, ClMnIIITPP; IVTPP(Y)>2O, Y = p-methoxyiodosylbenzene, 2,6-dimethyliodosylbenzene); | A 19 % Chromat. B 2 % Chromat. C 16 % Chromat. |
tetrachloromethane
Isobutane
di-tert-butyl peroxide
A
tertiary butyl chloride
B
chloroform
Conditions | Yield |
---|---|
at 140℃; |
tetrachloromethane
Isobutane
hexachloroethane
A
1,1,2,2-tetrachloroethylene
B
tertiary butyl chloride
Conditions | Yield |
---|---|
at 140℃; |
methylene
isopropyl chloride
A
s-butyl chloride
B
tertiary butyl chloride
C
isobutyryl chloride
Conditions | Yield |
---|---|
With aluminium trichloride |
Conditions | Yield |
---|---|
With water at 20℃; for 1.5h; | 100% |
With water | |
With water at 1℃; Rate constant; Thermodynamic data; solvolysis of tertiary, secondary, and primary substrates, thermodynamic data, temperature dependence; |
Conditions | Yield |
---|---|
With ethylaluminum dichloride bis(2-chloroethyl) ether complex In hexane; Cyclohexane-d12 at 25℃; for 2.5h; Catalytic behavior; Friedel-Crafts Alkylation; Glovebox; Inert atmosphere; regioselective reaction; | 100% |
bei Siedetemperatur; | |
at 75℃; unter Druck; |
Conditions | Yield |
---|---|
With aluminum (III) chloride In dichloromethane at 0 - 20℃; for 3h; Inert atmosphere; | 100% |
With aluminum tri-bromide In carbon disulfide at 40℃; for 0.5h; | 99% |
aluminium trichloride In carbon disulfide Heating; | 99% |
Conditions | Yield |
---|---|
iron(III) chloride In dichloromethane at 20℃; | 100% |
With iron(III) chloride In dichloromethane | 100% |
With iron(III) chloride In dichloromethane at 22 - 40℃; | 97% |
tertiary butyl chloride
N-cyano-S,S-diphenylsulfilimine
Conditions | Yield |
---|---|
With antimonypentachloride In 1,2-dichloro-ethane at 22℃; for 4h; | 100% |
tertiary butyl chloride
para-bromobenzenethiol
tert-butyl 4-bromophenyl sulfide
Conditions | Yield |
---|---|
With aluminium trichloride at 20℃; for 1h; | 100% |
aluminium trichloride at 35℃; for 0.166667h; | 96% |
With aluminium trichloride at 20℃; for 0.5h; | 87% |
tertiary butyl chloride
(tetramethylcyclopentadienyl)3U
chlorotris(tetramethylcyclopentadienyl)uranium(IV)
Conditions | Yield |
---|---|
In toluene byproducts: (CH3)3CC(CH3)3; (Ar); addn. of (CH3)3CCl to a soln. of uranium complex in toluene, stirring for 12 h; evapn.; | 100% |
tertiary butyl chloride
((7-bromo-3,4-dihydronaphthalen-1-yl)oxy)trimethylsilane
7-bromo-2-tert-butyltetralin-1-one
Conditions | Yield |
---|---|
With titanium tetrachloride In dichloromethane at -40 - 20℃; Inert atmosphere; | 100% |
With titanium tetrachloride In dichloromethane at -40 - 20℃; for 72h; Inert atmosphere; | 50% |
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 20℃; | 100% |
Conditions | Yield |
---|---|
With aluminum (III) chloride In dichloromethane at 0℃; for 24h; Inert atmosphere; | 100% |
With aluminum (III) chloride Friedel-Crafts Alkylation; | 98% |
1,2-dimethoxybenzene
tertiary butyl chloride
4-(tert-butyl)-1,2-dimethoxybenzene
Conditions | Yield |
---|---|
With iron(III) chloride In dichloromethane at 22℃; for 0.166667h; Inert atmosphere; | 100% |
10H-phenothiazine
tertiary butyl chloride
3,7-di-tert-butyl-10H-phenothiazine
Conditions | Yield |
---|---|
With aluminum (III) chloride In dichloromethane at 0 - 5℃; for 0.05h; | 99.5% |
With aluminum (III) chloride In dichloromethane at 0℃; Inert atmosphere; | 85% |
With aluminum (III) chloride In dichloromethane at 0℃; for 0.25h; Inert atmosphere; | 85% |
Stage #1: 10H-phenothiazine; tertiary butyl chloride With aluminum (III) chloride In dichloromethane at 0℃; Stage #2: With sodium acetate In water | 81% |
With aluminum (III) chloride In dichloromethane at 0℃; for 0.25h; Inert atmosphere; Schlenk technique; | 58% |
Conditions | Yield |
---|---|
With iodine at 50℃; Temperature; | 99.3% |
With iron(III) chloride at 0 - 20℃; | 85% |
With aluminium trichloride | 69% |
pyrene
tertiary butyl chloride
A
2,7-di-tertbutylpyrene
B
2-(tert-butyl)pyrene
Conditions | Yield |
---|---|
aluminium trichloride In carbon disulfide for 1h; Mechanism; Heating; various solvents; | A n/a B 99% |
With aluminium trichloride In dichloromethane for 3h; Ambient temperature; | A n/a B 63% |
With aluminum (III) chloride In dichloromethane at 0℃; for 3h; Inert atmosphere; | A 11% B 40% |
With aluminium trichloride In dichloromethane for 3h; Ambient temperature; Yields of byproduct given; |
tertiary butyl chloride
N-(1-phenylethylidene)cyanamide
Conditions | Yield |
---|---|
With antimonypentachloride In dichloromethane at -40℃; for 1.5h; | 99% |
Conditions | Yield |
---|---|
With aluminum (III) chloride at -40 - -15℃; for 2.33333h; Friedel-Crafts Alkylation; | 99% |
With aluminium trichloride at -40 - -10℃; for 3h; Friedel-Crafts alkylation; | 90% |
With aluminum (III) chloride at -40 - -10℃; for 2.5h; Inert atmosphere; | 72% |
tertiary butyl chloride
9-(4-nitrophenyl)-9H-carbazole
3,6-di-tert-butyl-9-(4-nitro-phenyl)-9H-carbazole
Conditions | Yield |
---|---|
With aluminium trichloride for 22h; | 99% |
With aluminium trichloride at 20℃; for 24h; Alkylation; Friedel-Crafts alkylation; | 94% |
With aluminum (III) chloride |
tertiary butyl chloride
diphenyl diselenide
tert-butyl phenyl selenide
Conditions | Yield |
---|---|
With indium; iodine In benzene | 99% |
With zinc In dichloromethane at 20℃; for 5h; | 86% |
With indium iodide In dichloromethane at 20℃; for 0.516667h; | 85% |
With indium In dichloromethane at 20℃; for 3h; | 99 % Chromat. |
Molecular structure of Propane, 2-chloro-2-methyl- (CAS NO.507-20-0) is:
Product Name: Propane, 2-chloro-2-methyl-
CAS Registry Number: 507-20-0
IUPAC Name: 2-Chloro-2-methylpropane
Molecular Weight: 92.56726 [g/mol]
Molecular Formula: C4H9Cl
XLogP3-AA: 1.8
EINECS: 208-066-4
Melting Point: -25 °C
Surface Tension: 20.2 dyne/cm
Density: 0.873 g/cm3
Flash Point: 18.3 °C
Enthalpy of Vaporization: 27.55 kJ/mol
Boiling Point: 50.6 °C at 760 mmHg
Vapour Pressure: 299 mmHg at 25°C
Refractive index: n20/D 1.385(lit.)
Storage temp.: Flammables area
Water Solubility: Slightly soluble
Stability: Stable. Extremely flammable. Note low flash point. Incompatible with strong oxidizing agents. Vapour, being much denser than air, may travel considerable distances to a source of ignition. Hygroscopic.
Product Categories: Organics; Chloro alkane compounds
Reported in EPA TSCA Inventory.
Safty information about Propane, 2-chloro-2-methyl- (CAS NO.507-20-0) is:
Questionable carcinogen with experimental neoplastigenic data. Dangerous fire hazard when exposed to heat, flame (sparks), and oxidizers. To fight fire, use water, spray, fog, alcohol foam, dry chemical. When heated to decomposition it emits toxic fumes of Cl−. See also CHLORINATED HYDROCARBONS, ALIPHATIC.
Hazard Codes: F
Risk Statements: 11
R11:Highly flammable.
Safety Statements: 16-29-33-7/9-9
S16:Keep away from sources of ignition.
S29:Do not empty into drains.
S33:Take precautionary measures against static discharges.
S7/9:Keep container tightly closed and in a well-ventilated place.
S9:Keep container in a well-ventilated place.
RIDADR: UN 1127 3/PG 2
WGK Germany: 1
RTECS: TX5040000
HazardClass: 3
PackingGroup: II
HS Code: 29031980
Propane, 2-chloro-2-methyl- , its cas register number is 507-20-0. It also can be called 2-Chloro-2-methylpropane ; 2-Chloroisobutane ; 2-Methyl-2-chloropropane ; 2-Methyl-2-propyl chloride ; 4-01-00-00288 (Beilstein Handbook Reference) ; AI3-30754 ; BRN 1730872 ; Chlorotrimethylmethane ; NSC 6527 ; Trimethylchloromethane ; tert-Butyl chloride ; tert-Butylchloride . It is a colourless liquid. When it is dissolved in water, a polar and protic solvent, the bulky chloride substituent is carried away by it, and isolated from the aliphatic chain, causing an heterolitic rupture of the compound, giving rise to a carbocation which eventually becomes a tertiary alcohol after a water molecule reacts with it, releasing hydrochloric acid as the final product.
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