2,3-Butanedione - ≥98% , CAS No.431-03-8

CAS: 431-03-8 Cat. No.: B104601 Fórmula: C4H6O2 Peso molecular: 86.09 Beilstein Registry Number: 1769 Número EC: 207-069-8
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
Buta-2,3-dione | Butane-2,3-dione | HSDB 297 | C00741 | dimethylglyoxal | F0001-1188 | 2,3-diketobutane | NCGC00090746-02 | SR-01000075811-1 | BDBM22725 | HMS3261M15 | 2,3-butanedione | EN300-19494 | FT-0609502 | NCGC00015336-04 | AKOS000118816 | NCGC0001
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice,FedEx DG Service
★
Size
Alemania (EU)
USA*
Price
Qty
25ml
B104601-25ml
—
8 Disponible
10,33€
100ml
B104601-100ml
—
4 Disponible
16,40€
500ml
B104601-500ml
Fabricado bajo pedido · 8–12 semanas
49,37€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

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

🌡

Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice,FedEx DG Service 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 54 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

2,3-Butanedione, a volatile compound, is a product of citrate metabolism that is generally produced by certain bacteria including Lactococcus lactis ssp. diacetylactis and Leuconostoc citrovorum. It has a typical buttery flavor and is commonly found in fermented dairy products, such as sour cream, yogurt and cottage cheese.

Inactivates aminopeptidase-N. Cyclocondensation with amines has been used to form triazine and pteridine ring systems. Also used as a precursor to α-diones.

Specifications

Sinónimos
Buta-2,3-dione | Butane-2,3-dione | HSDB 297 | C00741 | dimethylglyoxal | F0001-1188 | 2,3-diketobutane | NCGC00090746-02 | SR-01000075811-1 | BDBM22725 | HMS3261M15 | 2,3-butanedione | EN300-19494 | FT-0609502 | NCGC00015336-04 | AKOS000118816 | NCGC0001
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C,Argon charged
Enviado en
Wet ice,FedEx DG Service
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥98%
Nombres e identificadores
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504750402
Sonrisas canónicas
CC(=O)C(=O)C
IUPAC Name
butane-2,3-dione
InChIKey
QSJXEFYPDANLFS-UHFFFAOYSA-N
INCHI
1S/C4H6O2/c1-3(5)4(2)6/h1-2H3
Isómeros SMILES
CC(=O)C(=O)C
WGK Alemania
2
RTECS
EK2625000
Número ONU
2346
Grupo de embalaje
II
Peso molecular
86.09
Beilstein
1769
Reaxy-Rn
605398
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605398&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 oxygen compounds
ClaseOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones
Direct ParentAlpha-diketones
Alternative Parents Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Alpha-diketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as alpha-diketones. These are organic compounds containing two ketone groups on two adjacent carbon atoms.
External Descriptors a small molecule
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
CHRM1 Tclin Muscarinic acetylcholine receptor M1 (12690 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BCHE Tclin Butyrylcholinesterase (7174 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ARSA Tbio Cerebroside-sulfatase (655 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CES2 Tchem Carboxylesterase 2 (583 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CES1 Tchem Acyl coenzyme A:cholesterol acyltransferase (1029 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ACLY Tclin ATP-citrate synthase (168 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
THPO Tbio Thrombopoietin (834 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CBX1 Tbio Chromobox protein homolog 1 (92434 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Impa1 Inositol monophosphatase 1 (16203 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
nfo Endonuclease 4 (425 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
crtY Lycopene cyclase (9 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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.

39 results found

Lot NumberCertificate TypeFechaArticulo
F2612394Certificate of AnalysisJun 01, 2026 B104601
F2612354Certificate of AnalysisJun 01, 2026 B104601
F2612348Certificate of AnalysisJun 01, 2026 B104601
F2612346Certificate of AnalysisJun 01, 2026 B104601
F2603183Certificate of AnalysisNov 26, 2025 B104601
L2516351Certificate of AnalysisNov 26, 2025 B104601
L2516350Certificate of AnalysisNov 26, 2025 B104601
L2516201Certificate of AnalysisNov 26, 2025 B104601
L2516200Certificate of AnalysisNov 26, 2025 B104601
D2614058Certificate of AnalysisNov 26, 2025 B104601
J2430744Certificate of AnalysisOct 22, 2024 B104601
J2430414Certificate of AnalysisOct 22, 2024 B104601
J2430412Certificate of AnalysisOct 22, 2024 B104601
J2430403Certificate of AnalysisOct 22, 2024 B104601
D2412117Certificate of AnalysisMar 25, 2024 B104601
G2521059Certificate of AnalysisMar 25, 2024 B104601
G2521049Certificate of AnalysisMar 25, 2024 B104601
D2412118Certificate of AnalysisMar 25, 2024 B104601
D2412119Certificate of AnalysisMar 25, 2024 B104601
A2403150Certificate of AnalysisDec 22, 2023 B104601
A2403151Certificate of AnalysisDec 22, 2023 B104601
A2403152Certificate of AnalysisDec 22, 2023 B104601
A2403149Certificate of AnalysisDec 22, 2023 B104601
F23161025Certificate of AnalysisJun 10, 2023 B104601
F23161021Certificate of AnalysisJun 10, 2023 B104601
K2321262Certificate of AnalysisJun 10, 2023 B104601
F23161022Certificate of AnalysisJun 10, 2023 B104601
F23161023Certificate of AnalysisJun 10, 2023 B104601
F23161024Certificate of AnalysisJun 10, 2023 B104601
F23161028Certificate of AnalysisJun 10, 2023 B104601
F23161029Certificate of AnalysisJun 10, 2023 B104601
J2211671Certificate of AnalysisSep 23, 2022 B104601
J2211670Certificate of AnalysisSep 23, 2022 B104601
J2211632Certificate of AnalysisSep 23, 2022 B104601
F2213260Certificate of AnalysisJun 04, 2022 B104601
I2213239Certificate of AnalysisJun 04, 2022 B104601
F2213400Certificate of AnalysisJun 04, 2022 B104601
F2213266Certificate of AnalysisJun 04, 2022 B104601
F2213265Certificate of AnalysisJun 04, 2022 B104601
Propiedades químicas y físicas
SolubilidadMiscible with water.
Sensibilidadheat sensitive;air sensitive
Índice de refracción1.394
Punto de inflamación (°C)7 °C
Punto de ebullición (°C)88°C
Punto de fusión (°C)-4 °C
Peso molecular86.090 g/mol
XLogP3-1.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass86.0368 Da
Monoisotopic Mass86.0368 Da
Topological Polar Surface Area34.100 Ų
Heavy Atom Count6
Formal Charge0
Complexity71.500
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
Preguntas frecuentes y artículos
Citations of This Product
Calculadoras de soluciones
Reseñas

Reseñas de cliente

Preguntas frecuentes

What is the purity of this product?
This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.
How should this product be stored?
Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.
How is this product shipped?
This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 431-03-8, the molecular formula is C4H6O2, and the molecular weight is 86.09 g/mol. InChIKey QSJXEFYPDANLFS-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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