Ethyl 2-nitropropionate - ≥96% , CAS No.2531-80-8

CAS: 2531-80-8 Cat. No.: E169050 Formula: C5H9NO4 Peso molecolare: 147.13 Numero EC: 624-863-3
Disponibile su ordine
GRADE & PURITY ≥96%
Synonyms
DTXSID60870983 | NSC 63896 | ethyl 2-nitropropanoate | SY282953 | Ethyl 2-nitropropionate, 96% | EN300-84928 | D74922 | NSC63896 | NSC-63896 | J-015932 | AS-57940 | MFCD00024818 | AKOS015833357 | Propionic acid, 2-nitro-, ethyl ester | SCHEMBL1009673 | Et
Storage
Room temperature
Shipped In
Normal
★
Size
Germania (EU)
USA*
Price
Qty
200mg
E169050-200mg
Su ordinazione · 8–12 settimane
9,46€
1g
E169050-1g
—
5 Disponibile
35,49€
5g
E169050-5g
—
7 Disponibile
121,40€
25g
E169050-25g
—
2 Disponibile
366,97€
Enter a quantity for the sizes you want to add.
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Why this grade

≥96% 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.

Panoramica

Ethyl 2-nitropropionate is a nitro ester. 

Application:
Ethyl 2-nitropropionate was used in the preparation of:
(−)-trans-2,5-dimethylprolineethyl ester via enantioselective Michael reaction methyl vinyl ketone using modified dihydroquinine as catalyst;
novel nitrogen-15-labeled nitrone spin trap, 5-ethoxycarbonyl-5-methyl-1-pyrroline N-oxide ([15N]EMPO) for detecting superoxide anion;
2-ethoxycarbonyl-2-nitropentanal;

Specifications

Sinonimi
DTXSID60870983 | NSC 63896 | ethyl 2-nitropropanoate | SY282953 | Ethyl 2-nitropropionate, 96% | EN300-84928 | D74922 | NSC63896 | NSC-63896 | J-015932 | AS-57940 | MFCD00024818 | AKOS015833357 | Propionic acid, 2-nitro-, ethyl ester | SCHEMBL1009673 | Et
Specifiche e purezza
≥96%
Condizioni di conservazione di stoccaggio
Room temperature
Spedito in
Normal
Purezza
≥96%
Nomi e identificatori
Pubchem Sid488187096
Sorrisi canoniciCCOC(=O)C(C)[N+](=O)[O-]
IUPAC Nameethyl 2-nitropropanoate
InChIKeyZXBGJDZWJJFFQY-UHFFFAOYSA-N
INCHI1S/C5H9NO4/c1-3-10-5(7)4(2)6(8)9/h4H,3H2,1-2H3
Isomeri SMILES CCOC(=O)C(C)[N+](=O)[O-]
WGK Germania 3
Peso molecolare 147.13
Reaxy-Rn 774734
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774734&ln=

Documentazione

📋 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
ClasseCarboxylic acids and derivatives
SubclassAmino acids, peptides, and analogues
Intermediate Tree Nodes Amino acids and derivatives - Alpha amino acids and derivatives
Direct ParentAlpha amino acid esters
Alternative Parents Alanine and derivatives  Carboxylic acid esters  C-nitro compounds  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Monocarboxylic acids and derivatives  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Alpha-amino acid ester - Alanine or derivatives - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Certificati (CoA, COO, BSE/TSE e tabella di analisi)
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.

13 results found

Lot NumberCertificate TypeDataOggetto
H2205051Certificate of AnalysisMay 15, 2025 E169050
H2205052Certificate of AnalysisMay 15, 2025 E169050
J1830105Certificate of AnalysisJun 25, 2024 E169050
J1830106Certificate of AnalysisJun 12, 2024 E169050
A2404834Certificate of AnalysisDec 21, 2023 E169050
A2404835Certificate of AnalysisDec 21, 2023 E169050
G2312101Certificate of AnalysisJul 21, 2023 E169050
L2208163Certificate of AnalysisAug 29, 2022 E169050
L2208169Certificate of AnalysisAug 29, 2022 E169050
L2208172Certificate of AnalysisAug 29, 2022 E169050
L2208173Certificate of AnalysisAug 29, 2022 E169050
L2208182Certificate of AnalysisAug 29, 2022 E169050
H2205050Certificate of AnalysisJun 21, 2022 E169050

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Proprietà chimiche e fisiche
SolubilitàNot miscible in water.
Indice di rifrazione1.421 (lit.)
Punto di infiammabilità (°F)192.2 °F
Punto di infiammabilità (°C)89 °C
Punto di ebollizione (°C)75-76 °C/9 mmHg (lit.)
Peso molecolare147.130 g/mol
XLogP30.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass147.053 Da
Monoisotopic Mass147.053 Da
Topological Polar Surface Area72.100 Ų
Heavy Atom Count10
Formal Charge0
Complexity139.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calcolatori di soluzioni
Recensioni

Recensioni dei clienti

Domande frequenti

What is the purity of this product?
This product is supplied at ≥96% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.
How should this product be stored?
Store at room temperature.
How is this product shipped?
This product ships under standard ambient conditions. No temperature-controlled packaging is required.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 2531-80-8, the molecular formula is C5H9NO4, and the molecular weight is 147.13 g/mol. InChIKey ZXBGJDZWJJFFQY-UHFFFAOYSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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