Diethyl Ethylmalonate - ≥98%(GC) , CAS No.133-13-1

CAS: 133-13-1 Cat. No.: D155391 분자식: C9H16O4 분자량: 188.22 Beilstein Registry Number: 607635 EC 번호: 205-093-3
주문 가능
GRADE & PURITY ≥98%(GC)
Synonyms
69G92OYR3M | SCHEMBL230068 | MFCD00009167 | 1,1-PROPANEDICARBOXYLIC ACID,DIETHYL ESTER (MALONIC ACID,ETHYL,DIETHYL ESTER) | diethyl 2-ethylpropanedioate | F0001-0438 | DIETHYL .ALPHA.-ETHYLMALONATE | Propanedioic acid, ethyl-, diethyl ester | NSC 8706 |
Storage
Room temperature
Shipped In
Normal
★
Size
USA
독일 (EU)*
Price
Qty
25ml
D155391-25ml
8 재고 있음
—
US$11.90
100ml
D155391-100ml
5 재고 있음
—
US$23.90
500ml
D155391-500ml
주문제작 · 8~12주
US$66.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

동의어
69G92OYR3M | SCHEMBL230068 | MFCD00009167 | 1,1-PROPANEDICARBOXYLIC ACID,DIETHYL ESTER (MALONIC ACID,ETHYL,DIETHYL ESTER) | diethyl 2-ethylpropanedioate | F0001-0438 | DIETHYL .ALPHA.-ETHYLMALONATE | Propanedioic acid, ethyl-, diethyl ester | NSC 8706 |
사양 및 순도
≥98%(GC)
보관 조건
Room temperature
배송
Normal
순수함
≥98%(GC)
이름과 식별자
Pubchem Sid488180842
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488180842
정식 스마일CCC(C(=O)OCC)C(=O)OCC
IUPAC Namediethyl 2-ethylpropanedioate
InChIKeyVQAZCUCWHIIFGE-UHFFFAOYSA-N
INCHI1S/C9H16O4/c1-4-7(8(10)12-5-2)9(11)13-6-3/h7H,4-6H2,1-3H3
이성체 SMILES CCC(C(=O)OCC)C(=O)OCC
WGK 독일 2
분자량 188.22
Beilstein 607635
Reaxy-Rn 607635
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=607635&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
SuperclassLipids and lipid-like molecules
분류Fatty Acyls
SubclassFatty acid esters
Intermediate Tree Nodes Not available
Direct ParentFatty acid esters
Alternative Parents Dicarboxylic acids and derivatives  1,3-dicarbonyl compounds  Carboxylic acid esters  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Fatty acid ester - 1,3-dicarbonyl compound - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
설명This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
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.

5 results found

Lot NumberCertificate Type날짜항목
C1830031Certificate of AnalysisDec 22, 2025 D155391
G2404605Certificate of AnalysisApr 24, 2024 D155391
G2404606Certificate of AnalysisApr 24, 2024 D155391
D2307345Certificate of AnalysisFeb 14, 2022 D155391
F2329190Certificate of AnalysisFeb 14, 2022 D155391
화학 및 물리적 특성
굴절률1.42
발화점(°F)197.6 °F
발화점(°C)92 °C
끓는점(°C)211 °C
분자량188.220 g/mol
XLogP31.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass188.105 Da
Monoisotopic Mass188.105 Da
Topological Polar Surface Area52.600 Ų
Heavy Atom Count13
Formal Charge0
Complexity158.000
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
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