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ChemicalBook--->CAS DataBase List--->4300-97-4

4300-97-4

4300-97-4 Structure

4300-97-4 Structure
IdentificationMore
[Name]

3-Chloropivaloyl chloride
[CAS]

4300-97-4
[Synonyms]

3-chloro-2,2-dimethylpropanoyl chloride
3-CHLORO-2,2-DIMETHYLPROPIONYL CHLORIDE
3-CHLOROPIVALIC CHLORIDE
3-CHLOROPIVALOYL CHLORIDE
CHLOROPIVALOYL CHLORIDE
CPC
3-chloro-2,2-dimethylpropaneyl chloride
3-Chloro-2,2-dimethylpropionyl chloride, tech
Propanoyl chloride, 3-chloro-2,2-dimethyl-
B-Chloropivaloyl chloride
3-CHLOROPIVALOYL CHLORIDE 98%
β-Chloropivaloyl chloride, 3-Chloropivaloyl chloride
3-chloropivaloyl chloride,3-chloro-2,2-dimethyl propinyl chloride
2,2-Dimethyl-3-chloropropanoic acid chloride
2,2-Dimethyl-3-chloropropionic acid chloride
[EINECS(EC#)]

224-311-8
[Molecular Formula]

C5H8Cl2O
[MDL Number]

MFCD00000710
[Molecular Weight]

155.02
[MOL File]

4300-97-4.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to light yellow-brown liquid
[Boiling point ]

85-86 °C60 mm Hg(lit.)
[density ]

1.199 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.453(lit.)
[Fp ]

145 °F
[form ]

liquid
[color ]

Clear, colourless
[Specific Gravity]

1.199
[Water Solubility ]

reacts
[InChI]

InChI=1S/C5H8Cl2O/c1-5(2,3-6)4(7)8/h3H2,1-2H3
[InChIKey]

MQZNDDUMJVSIMH-UHFFFAOYSA-N
[SMILES]

C(Cl)(=O)C(C)(C)CCl
[CAS DataBase Reference]

4300-97-4(CAS DataBase Reference)
[EPA Substance Registry System]

4300-97-4(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

C,Xi
[Risk Statements ]

R34:Causes burns.
R36/37:Irritating to eyes and respiratory system .
R23:Toxic by inhalation.
R22:Harmful if swallowed.
[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 .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 3390 6.1/PG 1
[WGK Germany ]

3
[F ]

19
[Hazard Note ]

Irritant
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29159000
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Chlorine-->Pivaloyl chloride-->3-CHLORO-2,2-DIMETHYLPROPIONIC ACID
[Preparation Products]

Clomazone-->3-CHLORO-N-HYDROXY-2,2-DIMETHYL-PROPANAMIDE-->3-Amino-2,2-dimethylpropionamide-->3-CHLORO-N-(3,5-DIMETHOXYPHENYL)-2,2-DIMETHYLPROPANAMIDE-->3,3-Dimethyl-1-[2-nitro-4-(trifluoromethyl)phenyl]azetidin-2-one
Hazard InformationBack Directory
[General Description]

A colorless liquid. Very toxic by ingestion, inhalation and skin absorption. Flash point near 70°F. Corrosive. Contact may severely irritate skin, eyes, and mucous membranes. Used to make other chemicals.
[Reactivity Profile]

CHLOROPIVALOYL CHLORIDE(4300-97-4) is incompatible with strong oxidizing agents, alcohols, bases, including amines. May react vigorously or explosively if mixed with diisopropyl ether or other ethers in the presence of trace amounts of metal salts [J. Haz. Mat., 1981, 4, 291].
[Air & Water Reactions]

Highly flammable. Slightly soluble in water and less dense than water. Hence floats on water. Reacts with water to form hydrochloric acid (hydrogen chloride).
[Health Hazard]

TOXIC; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death. Contact with molten substance may cause severe burns to skin and eyes. Reaction with water or moist air will release toxic, corrosive or flammable gases. Reaction with water may generate much heat that will increase the concentration of fumes in the air. Fire will produce irritating, corrosive and/or toxic gases. Runoff from fire control or dilution water may be corrosive and/or toxic and cause pollution.
[Fire Hazard]

Combustible material: may burn but does not ignite readily. Substance will react with water (some violently) releasing flammable, toxic or corrosive gases and runoff. When heated, vapors may form explosive mixtures with air: indoors, outdoors and sewers explosion hazards. Most vapors are heavier than air. They will spread along ground and collect in low or confined areas (sewers, basements, tanks). Vapors may travel to source of ignition and flash back. Contact with metals may evolve flammable hydrogen gas. Containers may explode when heated or if contaminated with water.
[Description]

3-Chloropivaloyl chloride (also known as 3-chloro-2, 2-dimethylpropionyl chloride) is a vital acylation reagent and isoxazolone cyclization reagent, is widely used in the organic synthesis industry, is used primarily as a medical intermediate and a pesticide intermediate at present, and is used as a synthetic raw material of a rubber additive and a photographic photosensitive material.
[Chemical Properties]

clear colorless to light yellow-brown liquid
[Uses]

3-Chloropivaloyl Chloride is useful in the synthesis of compounds with antimicrobial and antioxidant activities.
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Chloro-2,2-dimethylpropanoyl chloride(4300-97-4).msds
Spectrum DetailBack Directory
[Spectrum Detail]

3-Chloropivaloyl chloride(4300-97-4)MS
3-Chloropivaloyl chloride(4300-97-4)1HNMR
3-Chloropivaloyl chloride(4300-97-4)13CNMR
3-Chloropivaloyl chloride(4300-97-4)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Chloropivaloyl chloride, 98%(4300-97-4)
[Sigma Aldrich]

4300-97-4(sigmaaldrich)
[TCI AMERICA]

3-Chloropivaloyl Chloride,>97.0%(T)(4300-97-4)
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