Ethyl Difluoroacetate - ≥99% , CAS No.454-31-9

CAS: 454-31-9 Cat. No.: E616466 분자식: C4H6F2O2 분자량: 124.09 EC 번호: 207-223-4
주문 가능
GRADE & PURITY ≥99%
Synonyms
BBL027798 | InChI=1/C4H6F2O2/c1-2-8-4(7)3(5)6/h3H,2H2,1H3 | EN300-35673 | GZKHDVAKKLTJPO-UHFFFAOYSA- | DTXSID0060010 | EC 207-223-4 | EINECS 207-223-4 | MFCD00013578 | Q-102546 | SCHEMBL238384 | Difluoroacetic Acid Ethyl Ester | Z361436550 | FT-0624918 |
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
Size
USA
독일 (EU)*
Price
Qty
5g
E616466-5g
2 재고 있음
US$10.90
25g
E616466-25g
2 재고 있음
US$19.90
100g
E616466-100g
1 재고 있음

US$44.90

US$63.90
저장 US$19.00 (29.73%)
500g
E616466-500g
1 재고 있음

US$192.90

US$239.90
저장 US$47.00 (19.59%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

동의어
BBL027798 | InChI=1/C4H6F2O2/c1-2-8-4(7)3(5)6/h3H,2H2,1H3 | EN300-35673 | GZKHDVAKKLTJPO-UHFFFAOYSA- | DTXSID0060010 | EC 207-223-4 | EINECS 207-223-4 | MFCD00013578 | Q-102546 | SCHEMBL238384 | Difluoroacetic Acid Ethyl Ester | Z361436550 | FT-0624918 |
사양 및 순도
≥99%
보관 조건
Store at 2-8°C,Argon charged
배송
Wet ice
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순수함
≥99%
이름과 식별자
Pubchem Sid508812111
정식 스마일CCOC(=O)C(F)F
IUPAC Nameethyl 2,2-difluoroacetate
InChIKeyGZKHDVAKKLTJPO-UHFFFAOYSA-N
INCHI1S/C4H6F2O2/c1-2-8-4(7)3(5)6/h3H,2H2,1H3
이성체 SMILES CCOC(=O)C(F)F
WGK 독일 3
UN 번호 2924
분자량 124.09
Reaxy-Rn 1748597
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1748597&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
분류Carboxylic 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  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl fluorides  
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 - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
설명This 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 구조
상호 작용 화학 구조 모델





인증서(CoA, COO, BSE/TSE 및 분석 차트)
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.

35 results found

Lot NumberCertificate Type날짜항목
A2622407Certificate of AnalysisJan 15, 2026 E616466
F2629017Certificate of AnalysisJan 15, 2026 E616466
A2622413Certificate of AnalysisJan 15, 2026 E616466
A2622411Certificate of AnalysisJan 15, 2026 E616466
A2622412Certificate of AnalysisJan 15, 2026 E616466
A2622406Certificate of AnalysisJan 15, 2026 E616466
L2512041Certificate of AnalysisMay 13, 2025 E616466
E2522324Certificate of AnalysisMay 13, 2025 E616466
E2522323Certificate of AnalysisMay 13, 2025 E616466
E2522322Certificate of AnalysisMay 13, 2025 E616466
B2506345Certificate of AnalysisDec 27, 2024 E616466
B2506364Certificate of AnalysisDec 27, 2024 E616466
B2506363Certificate of AnalysisDec 27, 2024 E616466
B2506351Certificate of AnalysisDec 27, 2024 E616466
K2419353Certificate of AnalysisNov 08, 2024 E616466
K2419351Certificate of AnalysisNov 08, 2024 E616466
K2419350Certificate of AnalysisNov 08, 2024 E616466
K2419348Certificate of AnalysisNov 08, 2024 E616466
G2424092Certificate of AnalysisJul 17, 2024 E616466
I2425066Certificate of AnalysisJul 17, 2024 E616466
G2424095Certificate of AnalysisJul 17, 2024 E616466
G2424094Certificate of AnalysisJul 17, 2024 E616466
G2424093Certificate of AnalysisJul 17, 2024 E616466
G2424091Certificate of AnalysisJul 17, 2024 E616466
G2424068Certificate of AnalysisJul 17, 2024 E616466
G2424067Certificate of AnalysisJul 17, 2024 E616466
D2411452Certificate of AnalysisMar 23, 2024 E616466
D2411451Certificate of AnalysisMar 23, 2024 E616466
C2426190Certificate of AnalysisMar 04, 2024 E616466
G2404012Certificate of AnalysisMar 04, 2024 E616466
C2426191Certificate of AnalysisMar 04, 2024 E616466
C2406249Certificate of AnalysisFeb 23, 2024 E616466
K2303066Certificate of AnalysisNov 08, 2023 E616466
K2303067Certificate of AnalysisNov 08, 2023 E616466
K2303168Certificate of AnalysisNov 08, 2023 E616466

Show more ⌵

화학 및 물리적 특성
감도Moisture sensitive.
굴절률1.347
발화점(°F)73.4 °F
발화점(°C)24 °C
끓는점(°C)99.2°C
분자량124.090 g/mol
XLogP30.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass124.034 Da
Monoisotopic Mass124.034 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count8
Formal Charge0
Complexity82.100
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
참고 문헌
1. Changxing Han, Yunpeng Qu, Borui Li, Wenkai Song, Hui Lin, Dongming Liu, Mengfan Pei, Shuo Zhuo, Lin Wang, Xin Jin, Wanyuan Jiang, Chang Su, Xusheng Zhang, Xigao Jian, Fangyuan Hu.  (2025)  Tailored Anion-Enriched Solvation Sheath Design Enables Wide Temperature Range Performance of Lithium Metal Batteries†.  CHINESE JOURNAL OF CHEMISTRY,      [PMID:] [10.1002/cjoc.70346]
2. Shichao Zhang, Siyuan Li, Yuezheng Liu, Jin Tang, Xinyang Wang, Wei Zhong, Shulan Mao, Qian Wu, Chaoqiang Tan, Ziren Long, Hao Cheng, Yong Wu, Yingying Lu.  (2026)  Molecular Engineering of Fluorinated Solvents Enables Practical Lithium Metal Batteries.  Advanced Energy Materials,      [PMID:] [10.1002/aenm.202506771]
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