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ChemicalBook >> CAS DataBase List >>Trichloroacetyl isocyanate

Trichloroacetyl isocyanate

CAS No.
3019-71-4
Chemical Name:
Trichloroacetyl isocyanate
Synonyms
2,2,2-TRICHLOROACETYL ISOCYANATE;trichloroethanecarbonyl isocyanate;Trichloroacetyl isocyate;trichloro-acetylisocyanat;TRICHLOROACETYL ISOCYANATE;Acetyl isocyanate, trichloro-;Trichloroacetyl isocyanate ,97%;Trichloroacetyl isocyanate, GC 97%;Acetyl isocyanate, 2,2,2-trichloro-;Isocyanic Acid Trichloroacetyl Ester
CBNumber:
CB1337310
Molecular Formula:
C3Cl3NO2
Molecular Weight:
188.4
MDL Number:
MFCD00002033
MOL File:
3019-71-4.mol
MSDS File:
SDS
Last updated:2026-05-27 23:36:05
Product description Number Pack Size Price
Trichloroacetyl isocyanate 96% 217328 1g $62.1
Trichloroacetyl isocyanate 96% 217328 10g $150
Trichloroacetyl Isocyanate >97.0%(N) T1047 1g $64
Trichloroacetyl Isocyanate >97.0%(N) T1047 5g $192
2,2,2,-Trichloroacetyl isocyanate Asreported 289630 10g $360
More product size

Trichloroacetyl isocyanate Properties

Melting point 135-140 °C
Boiling point 80-85 °C/20 mmHg (lit.)
Density 1.581 g/mL at 25 °C (lit.)
refractive index n20/D 1.480(lit.)
Flash point 150 °F
storage temp. 2-8°C
solubility Miscible with dichloromethane, ether, terahydrofuran and protic solvents.
form Liquid
color Clear colorless to slightly yellow
Water Solubility Decomposition
Sensitive Moisture Sensitive
BRN 971201
Stability Hygroscopic, Moisture Sensitive
InChI 1S/C3Cl3NO2/c4-3(5,6)2(9)7-1-8
InChIKey GRNOZCCBOFGDCL-UHFFFAOYSA-N
SMILES ClC(Cl)(Cl)C(=O)N=C=O
CAS DataBase Reference 3019-71-4(CAS DataBase Reference)
FDA UNII QXV1P5J6JL
NIST Chemistry Reference Trichloroacetyl isocyanate(3019-71-4)
EPA Substance Registry System Acetyl isocyanate, trichloro- (3019-71-4)
UNSPSC Code 12352100
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  Corrosion (GHS05)Skull and Crossbones (GHS06)Health Hazard (GHS08)
GHS05,GHS06,GHS08
Signal word  Danger
Hazard statements  H311+H331-H314-H317-H334
Precautionary statements  P261-P271-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
PPE Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
Hazard Codes  T
Risk Statements  14-23/24-34-42-23/24/25-36/37/38
Safety Statements  23-26-36/37/39-45-8-7/9
RIDADR  UN 2206 6.1/PG 3
WGK Germany  3
10-19
TSCA  TSCA listed
HazardClass  6.1
PackingGroup  II
HS Code  29291090
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Eye Dam. 1
Resp. Sens. 1
Skin Corr. 1B
Skin Sens. 1
REACH Registrations Inactive
NFPA 704
2
3 0
W

Trichloroacetyl isocyanate price More Price(56)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 217328 Trichloroacetyl isocyanate 96% 3019-71-4 1g $62.1 2026-04-30 Buy
Sigma-Aldrich 217328 Trichloroacetyl isocyanate 96% 3019-71-4 10g $150 2026-04-30 Buy
TCI Chemical T1047 Trichloroacetyl Isocyanate >97.0%(N) 3019-71-4 1g $64 2026-04-30 Buy
TCI Chemical T1047 Trichloroacetyl Isocyanate >97.0%(N) 3019-71-4 5g $192 2026-04-30 Buy
Usbiological 289630 2,2,2,-Trichloroacetyl isocyanate Asreported 3019-71-4 10g $360 2026-06-03 Buy
Product number Packaging Price Buy
217328 1g $62.1 Buy
217328 10g $150 Buy
T1047 1g $64 Buy
T1047 5g $192 Buy
289630 10g $360 Buy

Trichloroacetyl isocyanate Chemical Properties,Uses,Production

Chemical Properties

clear colorless to slightly yellow liquid

Uses

Trichloroacetyl isocyanate was used in catalytic one-pot dehydrative glycosylation of 1-hydroxy carbohydrate. It was also used as a reagent for the conversion of alcohols to carbamates.

Application

Trichloroacetyl Isocyanate is used as an in situ derivatizing reagent for characterization of alcohols, glycols, phenols, and amines by nuclear magnetic resonance (NMR).It has been reported in the literature that it can be used for the preparation of cefuroxime axetil.

Preparation

Trichloroacetyl isocyanate can be obtained by reacting 2,2,2-trichloroacetamide with oxalyl chloride.
Procedure: A reaction mixture of 2,2,2-trichloroacetamide (100 g, 616 mmol, 1.0 eq) in (COCl)2 (725 g, 5.71 mol, 500 mL, 9.28 eq) was heated to 70°C for 24 hours. The reaction mixture was concentrated under vacuum. To the mixture was added 1,2,4-trichlorobenzene (500 mL) and (COCl)2 (116 g, 914 mmol, 80 mL, 1.48 eq). The reaction mixture was stirred at 100°C for 5 hours. Heat to 125°C for 15 hours. The mixture was then heated to 140°C for 5 hours. The reaction mixture was distilled under water pump (72°C-76°C fractions) to give trichloroacetyl isocyanate (60 g, 319 mmol, 52% yield) as a colorless oil.

General Description

Conformational stability and vibrational IR and Raman spectra of trichloroacetyl isocyanate has been investigated. Trichloroacetyl isocyanate is commonly employed as in situ derivatizing reagent for the 13C NMR studies of alcohols, phenols and amines. It undergoes 1,5-cycloaddition reaction with anhydro-2-deoxy-D-erythro- and -L-threo-pent-1-enitols and 1,5-anhydro-2-deoxy-D- and -L-arabino-hex-1-enitols to yield [2+2] and [4+2] cycloadducts.

Global( 198)Suppliers
Supplier Tel Email Country ProdList Advantage
Hebei Chuanghai Biotechnology Co., Ltd
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Capot Chemical Co.,Ltd.
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Shenzhen Nexconn Pharmatechs Ltd
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CONIER CHEM AND PHARMA LIMITED
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Career Henan Chemica Co
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+86-0551-65418671 +8618949823763 sales@tnjchem.com China 34563 58
Wuhan Boye Science And Technology Development Co., Ltd.
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View Lastest Price from Trichloroacetyl isocyanate manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
Trichloroacetyl isocyanate pictures 2026-03-20 Trichloroacetyl isocyanate
3019-71-4
$8.00-10.00 1KG 99% 10 mt Hebei Chuanghai Biotechnology Co., Ltd
Trichloroacetyl isocyanate pictures 2025-12-01 Trichloroacetyl isocyanate
3019-71-4
1kg 99% 10000KGS Shaanxi Dideu New Materials Co. Ltd
Trichloroacetyl isocyanate pictures 2024-04-23 Trichloroacetyl isocyanate
3019-71-4
$10.00 1kg 99.8% 10000ton Ouhuang Engineering Materials (Hubei) Co., Ltd
TRICHLOROACETYL ISOCYANATE Acetyl isocyanate, trichloro- trichloro-acetylisocyanat Trichloroacetyl isocyanate, NMR grade Isocyanic Acid Trichloroacetyl Ester Trichloroacetyl isocyanate, GC 97% Trichloroacetyl isocyanate ,97% 1-Oxo-2,2,2-trichloroethyl isocyanate Trichloroacetyl isocyanate, NMR grade 10GR TRICHLOROACETYL ISOCYANATE FOR SYNTHESIS Trichloroacetyl isocyanate puruM, >=97.0% (GC) Trichloroacetyl Isocyanate, 98.0%(N) Acetyl isocyanate, 2,2,2-trichloro- trichloroethanecarbonyl isocyanate - [T86433] 2,2,2-TRICHLOROACETYL ISOCYANATE Trichloroacetyl isocyate trichloroethanecarbonyl isocyanate 3019-71-4 3019-71-5 C3Cl3NO2 Cl3CCONCO Isocyanates Nitrogen Compounds Organic Building Blocks Building Blocks Organics Isocyanates Nitrogen Compounds Organic Building Blocks Building Blocks Chemical Synthesis Nitrogen Compounds Organic Building Blocks
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