Ethyl 1-acetylcyclopropanecarboxylate - ≥97% , CAS No.32933-03-2

CAS: 32933-03-2 Cat. No.: E588742 Fórmula: C₈H₁₂O₃ Peso molecular: 156.18 Número CE: 696-336-6

GRAU & PUREZA ≥97%

Synonyms

ethyl 1-acetylcyclopropane-1-carboxylate | MFCD00480999 | AMY3939 | AKOS005348744 | EN300-97414 | ethyl 1-acetyl-1-cyclopropanecarboxylate | Ethyl1-acetylcyclopropanecarboxylate | 1-acetyl-cyclopropanecarboxylic acid ethyl ester | GG-0703 | AC-9393 | NSC3

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Especificações

Sinónimos

ethyl 1-acetylcyclopropane-1-carboxylate | MFCD00480999 | AMY3939 | AKOS005348744 | EN300-97414 | ethyl 1-acetyl-1-cyclopropanecarboxylate | Ethyl1-acetylcyclopropanecarboxylate | 1-acetyl-cyclopropanecarboxylic acid ethyl ester | GG-0703 | AC-9393 | NSC3

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Room temperature,Argon charged,Desiccated

Enviado em

Normal

Pureza

≥97%

Nomes e identificadores

Pubchem Sid

504758012

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758012

Sorrisos canónicos

CCOC(=O)C1(CC1)C(=O)C

IUPAC Name

ethyl 1-acetylcyclopropane-1-carboxylate

InChIKey

DISZFIFAESWGBI-UHFFFAOYSA-N

INCHI

1S/C8H12O3/c1-3-11-7(10)8(4-5-8)6(2)9/h3-5H2,1-2H3

SMILES isoméricas

CCOC(=O)C1(CC1)C(=O)C

CAS alternativo

32933-03-2

Número NSC

33602

Peso molecular

156.18

Reaxy-Rn

2207471

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2207471&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Keto acids and derivatives
      • Subclass Beta-keto acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Keto acids and derivatives
• Subclass: Beta-keto acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Beta-keto acids and derivatives
• Alternative Parents: Fatty acid esters Cyclopropanecarboxylic acids and derivatives Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Fatty acid ester - Beta-keto acid - Fatty acyl - Cyclopropanecarboxylic acid or derivatives - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound
• Descrição: This 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

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Sensibilidade: Air sensitive
• Índice de refração: 1.44
• Ponto de inflamação (°C): 80 °C
• Ponto de ebulição (°C): 44 °C/2 mmHg
• Peso molecular: 156.180 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 156.079 Da
• Monoisotopic Mass: 156.079 Da
• Topological Polar Surface Area: 43.400 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 192.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature, desiccated, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 32933-03-2, the molecular formula is C8H12O3, and the molecular weight is 156.18 g/mol. InChIKey DISZFIFAESWGBI-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.