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ChemicalBook--->CAS DataBase List--->594-65-0

594-65-0

594-65-0 Structure

594-65-0 Structure
IdentificationMore
[Name]

2,2,2-Trichloroacetamide
[CAS]

594-65-0
[Synonyms]

2,2,2-TRICHLOROACETAMIDE
TRICHLOROACETAMIDE
2,2,2-Chloroacetamide
2,2,2-trichloro-acetamid
Acetamide, alpha-trichloro-
alpha,alpha,alpha-Trichloroacetamide
alpha-trichloro-acetamid
Amid kyseliny trichloroctove
amidkyselinytrichloroctove
Trichloroacetaldoxime
Acetamide, 2,2,2-trichloro-
chloraloxime
alpha-trichloro-acetamide
a,a,a-Trichloroacetamide
Trichloroacetimidic acid
[EINECS(EC#)]

209-849-3
[Molecular Formula]

C2H2Cl3NO
[MDL Number]

MFCD00008009
[Molecular Weight]

162.4
[MOL File]

594-65-0.mol
Chemical PropertiesBack Directory
[Appearance]

off-white crystalline powder
[Melting point ]

139-141 °C(lit.)
[Boiling point ]

238-240 °C(lit.)
[density ]

1.4985 (rough estimate)
[refractive index ]

1.5450 (estimate)
[Fp ]

238-240°C
[storage temp. ]

-20°C Freezer, Under inert atmosphere
[solubility ]

methanol: 0.1 g/mL, clear
[form ]

Powder, Crystals and/or Chunks
[pka]

12.75±0.50(Predicted)
[color ]

White to off-white
[Stability:]

Stable. Incompatible with strong acids, strong bases, strong oxidizing agents, strong reducing agents.
[Water Solubility ]

13 g/L (20 ºC)
[BRN ]

1754028
[InChIKey]

UPQQXPKAYZYUKO-UHFFFAOYSA-N
[CAS DataBase Reference]

594-65-0(CAS DataBase Reference)
[NIST Chemistry Reference]

Acetamide, 2,2,2-trichloro-(594-65-0)
[EPA Substance Registry System]

594-65-0(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

T,Xn,Xi
[Risk Statements ]

R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
[Safety Statements ]

S36/37:Wear suitable protective clothing and gloves .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

3
[RTECS ]

AC9275000
[HS Code ]

29241900
[Toxicity]

LDLo orl-rat: 500 mg/kg JPETAB 90,260,47
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ammonium hydroxide
[Preparation Products]

Isatin-->Trichloroacetonitrile-->3-IMINO-2-INDOLINONE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2,2,2-Trichloroacetamide(594-65-0).msds
Hazard InformationBack Directory
[Chemical Properties]

off-white crystalline powder
[Uses]

2,2,2-Trichloroacetamide was an aliphatic halogenated DBP precursor identified in drinking water treatment; a pollutant.
[General Description]

Trichloroacetamide is the major degradation product of trichloroacetonitrile.
[Safety Profile]

Poison by intravenous route.Moderately toxic by ingestion and intraperitoneal routes.
[Purification Methods]

Its solution in xylene is dried with P2O5, then fractionally distilled. [Beilstein 2 IV 520.]
Spectrum DetailBack Directory
[Spectrum Detail]

2,2,2-Trichloroacetamide(594-65-0)MS
2,2,2-Trichloroacetamide(594-65-0)1HNMR
2,2,2-Trichloroacetamide(594-65-0)13CNMR
2,2,2-Trichloroacetamide(594-65-0)IR1
2,2,2-Trichloroacetamide(594-65-0)IR2
2,2,2-Trichloroacetamide(594-65-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2,2,2-Trichloroacetamide, 99%(594-65-0)
[Alfa Aesar]

2,2,2-Trichloroacetamide, 99%(594-65-0)
[Sigma Aldrich]

594-65-0(sigmaaldrich)
[TCI AMERICA]

Trichloroacetamide,>98.0%(T)(594-65-0)
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