Trichloroacetyl chloride
Names
[ CAS No. ]:
76-02-8
[ Name ]:
Trichloroacetyl chloride
[Synonym ]:
Trichloroacetochloride
Acetyl chloride, 2,2,2-trichloro-
Acetyl chloride, trichloro-
CCl3COCl
EINECS 200-926-7
TRICHLOROACETIC ACID CHLORIDE
Trichloroacetyl chloride [UN2442] [Corrosive]
MFCD00000792
Trichloroacetyl chloride
2,2,2-Trichloroethanoyl chloride
Chemical & Physical Properties
[ Density]:
1.7±0.1 g/cm3
[ Boiling Point ]:
118.0±0.0 °C at 760 mmHg
[ Melting Point ]:
-57 °C
[ Molecular Formula ]:
C2Cl4O
[ Molecular Weight ]:
181.833
[ Flash Point ]:
31.0±26.5 °C
[ Exact Mass ]:
179.870331
[ PSA ]:
17.07000
[ LogP ]:
2.39
[ Vapour Pressure ]:
17.0±0.2 mmHg at 25°C
[ Index of Refraction ]:
1.501
[ Stability ]:
Stable. Reacts violently with water. Incompatible with alcohols, oxidizing agents, strong bases.
[ Water Solubility ]:
reacts violently
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AO7140000
- CHEMICAL NAME :
- Acetyl chloride, trichloro-
- CAS REGISTRY NUMBER :
- 76-02-8
- BEILSTEIN REFERENCE NO. :
- 0774120
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 7
- MOLECULAR FORMULA :
- C2-Cl4-O
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 600 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,113,1982
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 475 mg/m3/4H
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,113,1982
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 445 mg/m3
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,113,1982 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X7270 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 1822 (estimated) No. of Female Employees: 272 (estimated)
Safety Information
[ Symbol ]:
GHS05, GHS06
[ Signal Word ]:
Danger
[ Hazard Statements ]:
H302-H314-H330
[ Supplemental HS ]:
Reacts violently with water.
[ Precautionary Statements ]:
P260-P280-P284-P305 + P351 + P338-P310
[ Personal Protective Equipment ]:
Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
[ Hazard Codes ]:
T+:Verytoxic;
[ Risk Phrases ]:
R14;R22;R26;R29;R35
[ Safety Phrases ]:
S26-S28-S36/37/39-S45-S8-S28A-S23
[ RIDADR ]:
UN 2442 8/PG 2
[ WGK Germany ]:
3
[ RTECS ]:
AO7140000
[ Packaging Group ]:
II
[ Hazard Class ]:
8
[ HS Code ]:
2914700090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2914700090
[ Summary ]:
HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%
Articles
J. Org. Chem. 78(7) , 3379-83, (2013)
The first examples of dihydro-1H-benzindoles by enantioselective γ-lactamization reaction of naphthyl sulfilimines with trichloroacetyl chloride in the presence of ZnCu as catalyst (≥98:2 er and 65-80...
Synthesis of 3-alkylbenzoxazolones from N-alkyl-N-arylhydroxylamines by contiguous O-trichloroacetylation, trichloroacetoxy ortho-shift, and cyclization sequence.J. Org. Chem. 78(23) , 11935-47, (2013)
Benzoxazolone pharmacophore is present in clinical pharmaceuticals, drug candidates, and many compounds having a wide spectrum of biological activities. The methods available for the synthesis of benz...
Interindividual variability in P450-dependent generation of neoantigens in halothane hepatitis.Chem. Biol. Interact. 116(1-2) , 123-41, (1998)
Halothane hepatitis occurs because susceptible patients mount immune responses to trifluoroacetylated protein antigens, formed following cytochrome P450-mediated bioactivation of halothane to trifluor...