Product Name

Stability

    Unstable. Light-sensitive.Highly flammable. Incompatible with strong oxidizing agents.Keep refrigerated below 10 C.

Toxicology

    Harmful if inhaled. Corrosive - may cause burns to the skin o
  • Melting Point
  • Formula C4H9 Cl O
  • Boiling Point °Cat760mmHg
  • Molecular Weight 108.568
  • Flash Point °C
  • Transport Information
  • Appearance yellowish liquid with an irritating odour
  • Safety A storage hazard. Ultraviolet light causes exothermic decomposition. Reacts violently with rubber. Reaction with sodium hydrogen cyanamide forms the explosive cyanonitrene. When heated to decomposition it emits toxic fumes of Cl−. See also HYPOCHLORITES.
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 507-40-4 (tert-Butyl Hypochlorite)
  • Hazard Symbols
  • Synonyms Hypochlorousacid, tert-butyl ester (8CI); 1,1-Dimethylethyl hypochlorite; tert-Butylhypochlorite
  • PSA 9.23000
  • LogP 1.95530

Synthetic route

tert-butyl alcohol
75-65-0

tert-butyl alcohol

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

Conditions
ConditionsYield
With sodium hypochlorite; acetic acid In water at 0℃; for 0.166667h; Darkness;75%
With sodium hypochlorite; acetic acid at 20 - 25℃;72.2%
With acetic acid for 0.05h;66%
hypochloric acid
14989-30-1

hypochloric acid

tert-butyl alcohol
75-65-0

tert-butyl alcohol

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

Conditions
ConditionsYield
In tetrachloromethane; water shaking a soln. of alcohol in CCl4 with an aq. soln. of HClO;; soln. of ester in CCl4 obtained;;
In tetrachloromethane; water shaking a soln. of alcohol in CCl4 with an aq. soln. of HClO;; soln. of ester in CCl4 obtained;;
sodium hypochlorite
7681-52-9

sodium hypochlorite

tert-butyl alcohol
75-65-0

tert-butyl alcohol

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

Conditions
ConditionsYield
With acetic acid at 0℃; Darkness;
{bis(trimethylsilyl)amino}-(t-butylimino)phosphane
54760-90-6, 95792-83-9

{bis(trimethylsilyl)amino}-(t-butylimino)phosphane

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

tert-butyl N-tert-butyl-N,N'-bis(trimethylsilyl)phosphoramidochloridimidate
79202-19-0

tert-butyl N-tert-butyl-N,N'-bis(trimethylsilyl)phosphoramidochloridimidate

Conditions
ConditionsYield
In benzene for 2h; Ambient temperature;100%
N-trimethylsilylimidophosphenous acid 2,2,6,6-tetramethylpiperidine
72821-01-3

N-trimethylsilylimidophosphenous acid 2,2,6,6-tetramethylpiperidine

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

P-chloro-O-tert-butyl-2,2,6,6-tetramethylpiperidido-N-trimethylsilylimidophosphate

P-chloro-O-tert-butyl-2,2,6,6-tetramethylpiperidido-N-trimethylsilylimidophosphate

Conditions
ConditionsYield
In benzene at 0℃; for 1h; argon atmosphere;100%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

N-propylbenzohydroxamic acid
72805-06-2

N-propylbenzohydroxamic acid

N-chloro-N-propoxybenzamide

N-chloro-N-propoxybenzamide

Conditions
ConditionsYield
In dichloromethane for 3h; anhydrous;100%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

2-chloro-1-(4-isopropylphenyl)-2-methylpropan-1-one

2-chloro-1-(4-isopropylphenyl)-2-methylpropan-1-one

2-chloro-1-(4-(2-chloropropan-2-yl)phenyl)-2-methylpropan-1-one

2-chloro-1-(4-(2-chloropropan-2-yl)phenyl)-2-methylpropan-1-one

Conditions
ConditionsYield
In chlorobenzene at -10 - 20℃; Inert atmosphere;100%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

N,N,N'-tris(trimethylsilyl)phosphenimidous amide
50732-21-3, 65428-75-3

N,N,N'-tris(trimethylsilyl)phosphenimidous amide

tert-butyl tris(trimethylsilyl)phosphoramidochlorimidate
79202-16-7

tert-butyl tris(trimethylsilyl)phosphoramidochlorimidate

Conditions
ConditionsYield
In benzene for 2h; Ambient temperature;98%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

N'-(1-adamantyl)-N,N-bis(trimethylsilyl)phosphorimidous amide
76889-11-7

N'-(1-adamantyl)-N,N-bis(trimethylsilyl)phosphorimidous amide

C20H42ClN2OPSi2
79202-21-4

C20H42ClN2OPSi2

Conditions
ConditionsYield
In benzene for 2h; Ambient temperature;95%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

(1,3-dimethylimidazol-2-ylidene)borane
1211417-77-4

(1,3-dimethylimidazol-2-ylidene)borane

(1,3-dimethyl-1H-imidazolium-2-yl)trichloroborate
1352941-55-9

(1,3-dimethyl-1H-imidazolium-2-yl)trichloroborate

Conditions
ConditionsYield
In dichloromethane at -78 - 20℃; for 1.05h; Schlenk technique; Inert atmosphere;94%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

N,N'-bis(t-butyl)-N-(trimethylsilyl)-phosphenimidous amide
53787-01-2, 87938-40-7

N,N'-bis(t-butyl)-N-(trimethylsilyl)-phosphenimidous amide

tert-butyl N,N'-di-tert-butyl-N-(trimethylsilyl)phosphoramidochloridimidate
79202-23-6

tert-butyl N,N'-di-tert-butyl-N-(trimethylsilyl)phosphoramidochloridimidate

Conditions
ConditionsYield
In benzene for 2h; Ambient temperature;93%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

LY 292223
130735-56-7

LY 292223

3-Chloro-2-(4-morpholinyl)-4H-1-benzopyran-4-one
130735-75-0

3-Chloro-2-(4-morpholinyl)-4H-1-benzopyran-4-one

Conditions
ConditionsYield
In dichloromethane; ethyl acetate91%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

2,4-dihydroxy-trifluoroacetophenone
182951-75-3

2,4-dihydroxy-trifluoroacetophenone

2,4-Dihydroxy-3-chloro-trifluoroacetophenone

2,4-Dihydroxy-3-chloro-trifluoroacetophenone

Conditions
ConditionsYield
In tetrachloromethane90%
tetrachloromethane
56-23-5

tetrachloromethane

(H3)triosmiumnonacarbonyl(μ3-CH)

(H3)triosmiumnonacarbonyl(μ3-CH)

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

(H3)triosmiumnonacarbonyl(μ3-CCl)

(H3)triosmiumnonacarbonyl(μ3-CCl)

Conditions
ConditionsYield
Heating H3Os3(CO)9(μ3-CH) at 45°C in CO-saturated CCl4 with excess t-BuOCl.; TLC on fluorescent silica (pentane);90%
...Expand
(H3)triosmiumnonacarbonyl(μ3-CH)

(H3)triosmiumnonacarbonyl(μ3-CH)

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

Bromotrichloromethane
75-62-7

Bromotrichloromethane

(H3)triosmiumnonacarbonyl(μ3-CBr)

(H3)triosmiumnonacarbonyl(μ3-CBr)

Conditions
ConditionsYield
Heating H3Os3(CO)9(μ3-CH) at 45°C in CO-saturated BrCCl3 with excess t-BuOCl.; TLC on fluorescent silica (pentane);90%
...Expand
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

phenylacetylene
536-74-3

phenylacetylene

benzoic acid
65-85-0

benzoic acid

1-(tert-butoxy)-2,2-dichloro-2-phenylethyl benzoate

1-(tert-butoxy)-2,2-dichloro-2-phenylethyl benzoate

Conditions
ConditionsYield
With tetrachloromethane at 30℃; for 2h; Schlenk technique;90%
...Expand
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

(C4H9)2(C6H5)SnCH(CH3)CH(CH3)OH

(C4H9)2(C6H5)SnCH(CH3)CH(CH3)OH

threo-iodo{3-(pivaloyloxy)but-2-yl}dibutylstannane

threo-iodo{3-(pivaloyloxy)but-2-yl}dibutylstannane

Conditions
ConditionsYield
With pyridine In diethyl ether byproducts: HCl; for 1 h at 0°C;; filtn.; washing with satd. CuSO4 soln. and NaHCO3 soln.; drying;;89%
3-(3-Acetaminophenyl)methyl-2,3,3a4,5,9b-hexahydro-1H-oxo-benz[e]isoindole

3-(3-Acetaminophenyl)methyl-2,3,3a4,5,9b-hexahydro-1H-oxo-benz[e]isoindole

3-(3-acetaminophenyl)methyl-2,3,3a,4,5,9b-hexahydro-1H-oxo-benz[e]isoindole
140378-02-5

3-(3-acetaminophenyl)methyl-2,3,3a,4,5,9b-hexahydro-1H-oxo-benz[e]isoindole

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

3-(5-Acetamino-2-chlorophenyl)methyl-2,3,3a,4,5,9b-hexahydro-1H-oxo-benz[e]isoindole
140378-03-6

3-(5-Acetamino-2-chlorophenyl)methyl-2,3,3a,4,5,9b-hexahydro-1H-oxo-benz[e]isoindole

Conditions
ConditionsYield
In chloroform86%
...Expand
3-(3-acetaminophenyl)methyl-2,3,3a,4,5,9b-hexahydro-1H-oxo-benz[e]isoindole
140378-02-5

3-(3-acetaminophenyl)methyl-2,3,3a,4,5,9b-hexahydro-1H-oxo-benz[e]isoindole

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

3-(5-Acetamino-2-chlorophenyl)methyl-2,3,3a,4,5,9b-hexahydro-1H-oxo-benz[e]isoindole
140378-03-6

3-(5-Acetamino-2-chlorophenyl)methyl-2,3,3a,4,5,9b-hexahydro-1H-oxo-benz[e]isoindole

Conditions
ConditionsYield
In chloroform86%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

6α-bromopenicillanic acid pivalolyloxymethyl ester
76468-87-6

6α-bromopenicillanic acid pivalolyloxymethyl ester

(pivaloyloxy)methyl 2-<(2'S,3'R)-2'-tert-butoxy-3'-bromo-4'-oxoazetidin-1'-yl>-3-methylbut-2-enoate
122348-01-0

(pivaloyloxy)methyl 2-<(2'S,3'R)-2'-tert-butoxy-3'-bromo-4'-oxoazetidin-1'-yl>-3-methylbut-2-enoate

Conditions
ConditionsYield
With 1-methyl-piperazine In chloroform for 0.166667h; Ambient temperature;85%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

methoxy-1 trimethylsiloxy-2 styrene
81699-72-1

methoxy-1 trimethylsiloxy-2 styrene

2-tert-Butoxy-2-methoxy-1-phenyl-ethanone
81699-78-7

2-tert-Butoxy-2-methoxy-1-phenyl-ethanone

Conditions
ConditionsYield
With mercury(II) oxide; tetrakis(triphenylphosphine) palladium(0) In toluene at -78℃; for 1h;85%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

(C4H9)2(C6H5)SnCH(CH3)CH(CH3)OH

(C4H9)2(C6H5)SnCH(CH3)CH(CH3)OH

erythro-iodo-{3-(pivaloyloxy)but-2-yl}dibutylstannane

erythro-iodo-{3-(pivaloyloxy)but-2-yl}dibutylstannane

Conditions
ConditionsYield
With pyridine In diethyl ether byproducts: HCl; for 1 h at 0°C;; filtn.; washing with satd. CuSO4 soln. and NaHCO3 soln.; drying;;85%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

C13H14BNO4
1152427-93-4, 1313054-20-4

C13H14BNO4

water
7732-18-5

water

2-(1-chloro-2-hydroxy-2-phenylethyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

2-(1-chloro-2-hydroxy-2-phenylethyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione

C13H15BClNO5

C13H15BClNO5

Conditions
ConditionsYield
With pyridine-4-carboxylic acid In acetone at -15℃;A 85%
B 6%
...Expand
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

ammonia
7664-41-7

ammonia

chloroamine
12190-75-9

chloroamine

Conditions
ConditionsYield
In methanol; tert-butyl alcohol at -40℃;80%
In neat (no solvent) equimolar amounts;; detection by spectroscopy;;
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

2-amino-5-bromo-3-methylbenzonitrile
1093966-37-0

2-amino-5-bromo-3-methylbenzonitrile

2,2'-(diazene-1,2-diyl)bis(5-bromo-3-methylbenzonitrile)

2,2'-(diazene-1,2-diyl)bis(5-bromo-3-methylbenzonitrile)

Conditions
ConditionsYield
With potassium iodide In acetonitrile at -10℃; Temperature; Inert atmosphere;80%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

1-ethyl-3-methylimidazolium dicyanodihydridoborate

1-ethyl-3-methylimidazolium dicyanodihydridoborate

C2BCl2N2(1-)*C6H11N2(1+)

C2BCl2N2(1-)*C6H11N2(1+)

Conditions
ConditionsYield
In dichloromethane at 0 - 20℃; for 12h; Darkness;79%
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

C14H15BFNO4

C14H15BFNO4

water
7732-18-5

water

C14H16BClFNO5

C14H16BClFNO5

Conditions
ConditionsYield
With pyridine-4-carboxylic acid In acetone at -15℃; Reagent/catalyst; Solvent; Temperature;78%
...Expand
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

(2S,3S)-3-(tert-butyldiphenylsilyloxy)-2-methylbutanal oxime
1132969-93-7

(2S,3S)-3-(tert-butyldiphenylsilyloxy)-2-methylbutanal oxime

(S,Z)-1-(trityloxy)pent-3-en-2-ol
1132969-94-8

(S,Z)-1-(trityloxy)pent-3-en-2-ol

(R)-1-((4S,5R)-3-((2S,3S)-3-(tert-butyldiphenylsilyloxy)butan-2-yl)-4-methyl-4,5-dihydroisoxazol-5-yl)-2-(trityloxy)ethanol
1132969-95-9

(R)-1-((4S,5R)-3-((2S,3S)-3-(tert-butyldiphenylsilyloxy)butan-2-yl)-4-methyl-4,5-dihydroisoxazol-5-yl)-2-(trityloxy)ethanol

Conditions
ConditionsYield
Stage #1: tert-butylhypochlorite; (2S,3S)-3-(tert-butyldiphenylsilyloxy)-2-methylbutanal oxime In dichloromethane at -78℃; Inert atmosphere;
Stage #2: (S,Z)-1-(trityloxy)pent-3-en-2-ol With ethylmagnesium bromide In diethyl ether; dichloromethane; isopropyl alcohol at 0 - 20℃; Inert atmosphere;		76%
...Expand
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

phenylacetylene
536-74-3

phenylacetylene

Trimethylacetic acid
75-98-9

Trimethylacetic acid

1-(tert-butoxy)-2,2-dichloro-2-phenylethyl pivalate

1-(tert-butoxy)-2,2-dichloro-2-phenylethyl pivalate

Conditions
ConditionsYield
With tetrachloromethane at 60℃; for 1h; Schlenk technique;76%
...Expand
2-Picolinic acid
98-98-6

2-Picolinic acid

tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

phenylacetylene
536-74-3

phenylacetylene

1-(tert-butoxy)-2,2-dichloro-2-phenylethyl picolinate

1-(tert-butoxy)-2,2-dichloro-2-phenylethyl picolinate

Conditions
ConditionsYield
With tetrachloromethane at 30℃; for 1h; Schlenk technique;76%
...Expand
tert-butylhypochlorite
507-40-4

tert-butylhypochlorite

o-toluidine
95-53-4

o-toluidine

2-methyl-6-(thiomethoxymethyl)-aniline

2-methyl-6-(thiomethoxymethyl)-aniline

Conditions
ConditionsYield
With sodium methylate In methanol; dichloromethane; water75%
With sodium methylate In methanol; dichloromethane; water75%

tert-BUTYL HYPOCHLORITE Chemical Properties

MF: C4H9ClO
MW: 108.57
EINECS: 208-072-7
Synonyms/Related:t-Butyl hypochlorite;Tert-Butyl Hypochlorite,Hypochlorous Acid tert-Butyl Ester.
Tert-BUTYL HYPOCHLORITE is a slightly yellowish liquid with a pungent odor. Water insoluble. Flash point near 0°F.
Tert-Butyl hypochlorite is a versatile and inexpensive oxidizing agent, that allows the conversion of alcohols to ketones, aldehydes to acid chlorides, sulfides to sulfoxides, and hydroxylamines to nitroso compounds.The more reactive compound tert-Butyl hypoiodide, can be prepared from tert-butyl hypochlorite and a metal iodide

tert-BUTYL HYPOCHLORITE Uses

tert-BUTYL HYPOCHLORITE is a chlorination agent used in unsaturated rubber.

tert-BUTYL HYPOCHLORITE Safety Profile

A storage hazard. Ultraviolet light causes exothermic decomposition. Reacts violently with rubber. Reaction with sodium hydrogen cyanamide forms the explosive cyanonitrene. When heated to decomposition it emits toxic fumes of Cl−. See also HYPOCHLORITES.

It is corrosive to the skin, eyes, and mucous membranes.
If fire,it will produce irritating, corrosive and/or toxic gases. Inhalation of decomposition products may cause severe injury or death. Contact with substance may cause severe burns to skin and eyes. Runoff from fire control may cause pollution.

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