3-Methoxycyclohexene - ≥97% , CAS No.2699-13-0

CAS: 2699-13-0 Cat. No.: M158043 Fórmula: C₇H₁₂O Peso molecular: 112.17 Número CE: 805-871-8

GRADE & PURITY ≥97%

Synonyms

1-Cyclohexene, 3-methoxy- | AKOS006280591 | NSC155565 | NSC-155565 | NSC 155565 | 1-Cyclohexene, 3-methoxy-, | 3-methox ycyclohexene | D91600 | Cyclohexene, 3-methoxy- | 3-Methoxycyclohexene | 3-methoxy-cyclohexene | MFCD00013777 | SCHEMBL2755809 | 3-meth

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

1-Cyclohexene, 3-methoxy- | AKOS006280591 | NSC155565 | NSC-155565 | NSC 155565 | 1-Cyclohexene, 3-methoxy-, | 3-methox ycyclohexene | D91600 | Cyclohexene, 3-methoxy- | 3-Methoxycyclohexene | 3-methoxy-cyclohexene | MFCD00013777 | SCHEMBL2755809 | 3-meth

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Store at -20°C,Argon charged

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥97%

Nomes e identificadores

• Sorrisos canónicos: COC1CCCC=C1
• IUPAC Name: 3-methoxycyclohexene
• InChIKey: OKDKFTKUXADLSJ-UHFFFAOYSA-N
• INCHI: 1S/C7H12O/c1-8-7-5-3-2-4-6-7/h3,5,7H,2,4,6H2,1H3
• SMILES isoméricas: COC1CCCC=C1
• Peso molecular: 112.17
• Reaxy-Rn: 1853430
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1853430&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Aliphatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• 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

• Índice de refração: 1.46
• Ponto de inflamação (°C): 27 °C
• Ponto de ebulição (°C): 133°C(lit.)
• Peso molecular: 112.170 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 112.089 Da
• Monoisotopic Mass: 112.089 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 86.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• 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 ?20 °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 in an insulated container with ice pads. 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 2699-13-0, the molecular formula is C7H12O, and the molecular weight is 112.17 g/mol. InChIKey OKDKFTKUXADLSJ-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.