Allyl acetoacetate - ≥97% , CAS No.1118-84-9

CAS: 1118-84-9 Cat. No.: A111254 Fórmula: C7H10O3 Peso molecular: 142.15 Beilstein Registry Number: 1758569 Número CE: 214-269-9
Disponível para encomenda
GRADE & PURITY ≥97%
Synonyms
BBL011433 | EINECS 214-269-9 | STL146541 | Allyl acetoacetate, 98% | Allyl 3-oxobutanoate # | Allyl acetoacetate | allyl aceto-acetate | J-002655 | 8HX066J62P | 2-chromanone | MFCD00009811 | NSC24280 | NSC-24280 | Acetoacetic acid, allyl ester | Allylacet
Storage
Room temperature
Shipped In
Normal
★
Size
Alemanha (EU)
USA*
Price
Qty
25ml
A111254-25ml
—
8 Em stock
14,66€
100ml
A111254-100ml
—
3 Em stock
51,98€
500ml
A111254-500ml
1 Em stock
2 Em stock
216,85€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥97% 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 3 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
BBL011433 | EINECS 214-269-9 | STL146541 | Allyl acetoacetate, 98% | Allyl 3-oxobutanoate # | Allyl acetoacetate | allyl aceto-acetate | J-002655 | 8HX066J62P | 2-chromanone | MFCD00009811 | NSC24280 | NSC-24280 | Acetoacetic acid, allyl ester | Allylacet
Especificações e pureza
≥97%
Condições de armazenamento de armazenamento
Room temperature
Enviado em
Normal
Pureza
≥97%
Nomes e identificadores
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488184570
Sorrisos canónicos
CC(=O)CC(=O)OCC=C
IUPAC Name
prop-2-enyl 3-oxobutanoate
InChIKey
AXLMPTNTPOWPLT-UHFFFAOYSA-N
INCHI
1S/C7H10O3/c1-3-4-10-7(9)5-6(2)8/h3H,1,4-5H2,2H3
SMILES isoméricas
CC(=O)CC(=O)OCC=C
Número UN
2810
Grupo de embalagem
III
Peso molecular
142.15
Beilstein
1758569
Reaxy-Rn
1758569
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1758569&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
ClasseKeto acids and derivatives
SubclassBeta-keto acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentBeta-keto acids and derivatives
Alternative Parents Fatty acid esters  1,3-dicarbonyl compounds  Ketones  Carboxylic acid esters  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Fatty acid ester - Beta-keto acid - Fatty acyl - 1,3-dicarbonyl compound - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
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.

10 results found

Lot NumberCertificate TypeDataItem
A2307109Certificate of AnalysisJul 03, 2026 A111254
A2307110Certificate of AnalysisJul 03, 2026 A111254
A2307115Certificate of AnalysisJul 03, 2026 A111254
A2307116Certificate of AnalysisJul 03, 2026 A111254
H1907162Certificate of AnalysisJul 09, 2025 A111254
A2307111Certificate of AnalysisOct 12, 2024 A111254
J2028252Certificate of AnalysisMay 11, 2024 A111254
G2219008Certificate of AnalysisApr 15, 2024 A111254
G2219009Certificate of AnalysisApr 15, 2024 A111254
G2219010Certificate of AnalysisApr 15, 2024 A111254
Propriedades químicas e físicas
SolubilidadeSoluble in water
SensibilidadeAir Sensitive
Índice de refração1.439
Ponto de inflamação (°F)67°C
Ponto de inflamação (°C)152.6℉
Ponto de ebulição (°C)194-195°C
Ponto de fusão (°C)-85 °C
Peso molecular142.150 g/mol
XLogP30.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass142.063 Da
Monoisotopic Mass142.063 Da
Topological Polar Surface Area43.400 Ų
Heavy Atom Count10
Formal Charge0
Complexity149.000
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
FAQs e artigos
Citations of This Product
Calculadoras de soluções
Revisões

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