ChemicalBook--->CAS DataBase List--->598-31-2

598-31-2

598-31-2 Structure

598-31-2 Structure
IdentificationMore
[Name]

BROMOACETONE
[CAS]

598-31-2
[Synonyms]

1-BROMO-2-PROPANONE
Acetoffyl bromide
BROMO-2-PROPANONE
BROMOACETONE
Bromopropanone
1-bromo-2-propanon
1-Bromo-2-Propaone
1-Bromoacetone
1-bromo-propan-2-one
2-Propanone, bromo-
2-propanone,1-bromo-
Acetonyl bromide
acetonylbromide
Acetylmethyl bromide
acetylmethylbromide
alpha-Bromoacetone
bromo-2-propanon
Bromomethyl methyl ketone
bromomethylmethylketone
B-Stoff
[EINECS(EC#)]

209-928-2
[Molecular Formula]

C3H5BrO
[MDL Number]

MFCD00039188
[Molecular Weight]

136.98
[MOL File]

598-31-2.mol
Chemical PropertiesBack Directory
[Appearance]

Colorless liquid when pure, rapidly becomes violet even in absence of air. Soluble in ace- tone, alcohol, benzene, and ether; slightly soluble in water.
[Melting point ]

-36,5°C
[Boiling point ]

137°C
[density ]

1,63 g/cm3
[refractive index ]

nD15 1.4697
[Fp ]

51℃
[Specific Gravity]

1.63 (0℃)
[InChI]

InChI=1S/C3H5BrO/c1-3(5)2-4/h2H2,1H3
[InChIKey]

VQFAIAKCILWQPZ-UHFFFAOYSA-N
[SMILES]

C(Br)C(=O)C
[CAS DataBase Reference]

598-31-2(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Propanone, 1-bromo-(598-31-2)
[EPA Substance Registry System]

598-31-2(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)
GHS02
[Signal word ]

Warning
[Hazard statements ]

H226
[Risk Statements ]

R11:Highly Flammable.
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R34:Causes burns.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

1569
[HazardClass ]

6.1(a)
[PackingGroup ]

II
[HS Code ]

29147000
[Safety Profile]

A poisonous gas. Moderately toxic to humans by inhalation. When heated to decomposition it emits toxic fumes of Br-. See also BROMIDES.
[Hazardous Substances Data]

598-31-2(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Acetic acid-->Sodium carbonate-->Bromine-->Acetone-->Calcium chloride
[Preparation Products]

NAPROANILIDE-->Bromoform-->4,5,6,7-Tetrahydro-2-methylfuro[3,2-c]pyridine-->1,1-Diphenylacetone-->Hydroxyacetone-->3-Bromo-2-methoxy-propene-->1-(4-Chlorophenyl)-1-phenylacetone-->4-Methylthiazole-2-carboxylic acid ethylester-->6-chloro-2,8-dimethyl-Imidazo[1,2-b]pyridazine-->1-(Benzylthio)acetone-->(4-Chlorophenylthio)acetone-->6-chloro-2,7-dimethyl-Imidazo[1,2-b]pyridazine-->Methylsulfonylacetone-->1-Bromo-2,2-dimethoxypropane-->2-Acetamidopyridine-->N-Acetonylpyridinium bromide
Hazard InformationBack Directory
[General Description]

A clear colorless liquid turning violet on standing, even in the absence of air, and decomposing to a black resinous mass on long standing. Denser than water and poorly soluble in water. Hence sinks in water. A violent lachrymator--low concentrations are very irritating to the eyes; high concentrations or prolonged exposure at lower concentrations may have adverse health effects. Very toxic by inhalation. Contact with the liquid causes painful burns. Used as a chemical war gas.
[Reactivity Profile]

BROMOACETONE(598-31-2) decomposes on standing.
[Air & Water Reactions]

Highly flammable. Soluble in water.
[Hazard]

Toxic by inhalation and skin contact. A lachrymator gas, strong irritant.
[Health Hazard]

Very powerful lachrymator and upper respiratory tract irritant. Intensely irritating to the eyes, nose, throat, and lungs. Corrosive to the skin.
[Fire Hazard]

Special Hazards of Combustion Products: Toxic fumes of Bromine
[Chemical Properties]

Colorless liquid when pure, rapidly becomes violet even in absence of air. Soluble in ace- tone, alcohol, benzene, and ether; slightly soluble in water.
[Uses]

Chemical war gas.
[Definition]

ChEBI: An alpha-bromoketone that is acetone in which one of the hydrogens is replaced by a bromine atom. A poweful lachrymator, it was formerly used as a chemical weapon.
[Purification Methods]

Stand bromoacetone over anhydrous CaCO3, filter, distil it under low vacuum, and store it with CaCO3 in the dark at 0o. [Levene Org Synth Coll Vol II 88 1943.] Violently LACHRYMATORY and skin IRRITANT.
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

bromopropanone(598-31-2).msds
Spectrum DetailBack Directory
[Spectrum Detail]

BROMOACETONE(598-31-2)MS
BROMOACETONE(598-31-2)1HNMR
BROMOACETONE(598-31-2)13CNMR
BROMOACETONE(598-31-2)IR1
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

Bromoacetone  (stabilized with MgO),>90.0%(GC)(598-31-2)
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