Ethyl trichloroacetate - ≥97% , CAS No.515-84-4

CAS: 515-84-4 Cat. No.: E104083 Molecular Weight: 191.44 Beilstein Registry Number: 1761567 EC Number: 208-212-7
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
ethyl 2,2,2-trichloroacetate | BR8FKN5Z55 | ethyl-2,2,2-trichloroacetate | SY049287 | AS-53570 | Q27274835 | SB40694 | Acetic acid, trichloro-, ethyl ester | ETHYL TRICHLOROACETATE | 2,2,2-trichloroacetic acid ethyl ester
Storage
Argon charged,Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
25g
E104083-25g
7

$38.90

$58.90
Save $20.00 (33.96%)
100g
E104083-100g
9

$83.90

$125.90
Save $42.00 (33.36%)
500g
E104083-500g
1

$109.90

$164.90
Save $55.00 (33.35%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 4 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Ethyl trichloroacetate undergoes atom-transfer radical addition reaction with styrene catalyzed by the Ru-pentamethylcyclopentadienyl complexes.
Ethyl trichloroacetate was used in the synthesis of dichlorocarbon precursor, phenyl(trichloromethyl)methyl.

Specifications

Synonyms
ethyl 2, 2, 2-trichloroacetate | BR8FKN5Z55 | ethyl-2, 2, 2-trichloroacetate | SY049287 | AS-53570 | Q27274835 | SB40694 | Acetic acid, trichloro-, ethyl ester | ETHYL TRICHLOROACETATE | 2, 2, 2-trichloroacetic acid ethyl ester
Specifications & Purity
≥97%
Storage
Argon charged, Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid488181149
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181149
Canonical SmilesCCOC(=O)C(Cl)(Cl)Cl
IUPAC Nameethyl 2,2,2-trichloroacetate
InChIKeySJMLNDPIJZBEKY-UHFFFAOYSA-N
INCHI1S/C4H5Cl3O2/c1-2-9-3(8)4(5,6)7/h2H2,1H3
Isomeric SMILES CCOC(=O)C(Cl)(Cl)Cl
WGK Germany 1
Molecular Weight 191.44
Beilstein 1761567
Reaxy-Rn 1761567
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1761567&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
SubclassAlpha-halocarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentAlpha-halocarboxylic acid derivatives
Alternative Parents Carboxylic acid esters  Monocarboxylic acids and derivatives  Organochlorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl chlorides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Alpha-halocarboxylic acid derivative - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as alpha-halocarboxylic acid derivatives. These are carboxylic acid derivatives containing a halogen atom bonded to the alpha carbon atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

15 results found

Lot NumberCertificate TypeDateItem
D2428207Certificate of AnalysisFeb 05, 2026 E104083
D2428209Certificate of AnalysisFeb 05, 2026 E104083
D2310297Certificate of AnalysisJan 15, 2025 E104083
D2310337Certificate of AnalysisJan 15, 2025 E104083
C2513431Certificate of AnalysisNov 16, 2024 E104083
C2513432Certificate of AnalysisNov 16, 2024 E104083
C2513483Certificate of AnalysisNov 16, 2024 E104083
C2611043Certificate of AnalysisNov 16, 2024 E104083
E2628026Certificate of AnalysisNov 16, 2024 E104083
B2310624Certificate of AnalysisNov 14, 2024 E104083
D2428208Certificate of AnalysisApr 17, 2024 E104083
D2428210Certificate of AnalysisApr 17, 2024 E104083
K2105059Certificate of AnalysisAug 07, 2023 E104083
K2105062Certificate of AnalysisAug 07, 2023 E104083
C2308365Certificate of AnalysisOct 21, 2021 E104083

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Chemical and Physical Properties
Solubilitysolubility alcohol: miscible(lit.) diethyl ether: miscible(lit.) water: insoluble(lit.)
SensitivityAir Sensitive
Refractive Index1.4507
Flash Point(°F)163.4 °F
Flash Point(°C)65℃
Boil Point(°C)168°C
Molecular Weight191.440 g/mol
XLogP32.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass189.936 Da
Monoisotopic Mass189.936 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count9
Formal Charge0
Complexity107.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
References
1. Ruiyao Wu, Zhen Niu, Zhu Xia, Jianyun He, Chenxi Bai.  (2023)  Synthesis and dynamic crosslinking of a hydroxyl-functionalized ethylene-propylene copolymer: Preparation of an elastomer with reprocessability and shape memory properties.  POLYMER,      [PMID:] [10.1016/j.polymer.2023.126396]
2. Baozheng Tian, Xianwei Zhang, Hong Fan.  (2019)  Synthesis of polyethylene-g-polydimethylsiloxane graft copolymers by copolymerization of ethylene with polydimethylsiloxane macromonomer.  EUROPEAN POLYMER JOURNAL,      [PMID:] [10.1016/j.eurpolymj.2019.06.016]
3. Xiufeng Hao, Chundi Zhang, Lin Li, Hexin Zhang, Yanming Hu, Daifeng Hao, Xuequan Zhang.  (2017)  Use of Vanadium Complexes Bearing Naphthalene-Bridged Nitrogen-Sulfonate Ligands as Catalysts for Copolymerization of Ethylene and Propylene.  Polymers,  (8): (325).  [PMID:30971000] [10.3390/polym9080325]
4. Xiaoyu Qi, Zhenguo Liu, Wei Gao.  (2025)  One-Pot Synthesis of Thiophenoxyimino Vanadium Complexes and Highly Active Catalysis on Ethylene Polymerization.  APPLIED ORGANOMETALLIC CHEMISTRY,  40  (1): (e70492).  [PMID:] [10.1002/aoc.70492]
Solution Calculators
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