4-Ethoxycyclohexanone - ≥97% , CAS No.23510-92-1

CAS: 23510-92-1 Cat. No.: E168868 Formula: C₈H₁₄O₂ Peso molecolare: 142.20 Numero EC: 807-314-4

GRADE & PURITY ≥97%

Synonyms

4-(Ethyloxy)cyclohexanone | DTXSID80338111 | 4-Ethoxycyclohexanone, AldrichCPR | 4-ethoxycyclohexan-1-one | YAA51092 | BBL101666 | MFCD16620299 | SCHEMBL600575 | PS-5651 | 4-Ethoxycyclohexanone | 4-ethoxy-cyclohexanone | A878221 | FT-0684426 | 4-Ethoxycyc

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinonimi

4-(Ethyloxy)cyclohexanone | DTXSID80338111 | 4-Ethoxycyclohexanone, AldrichCPR | 4-ethoxycyclohexan-1-one | YAA51092 | BBL101666 | MFCD16620299 | SCHEMBL600575 | PS-5651 | 4-Ethoxycyclohexanone | 4-ethoxy-cyclohexanone | A878221 | FT-0684426 | 4-Ethoxycyc

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Store at 2-8°C

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥97%

Nomi e identificatori

• Sorrisi canonici: CCOC1CCC(=O)CC1
• IUPAC Name: 4-ethoxycyclohexan-1-one
• InChIKey: LVEFFFUKMDNCBN-UHFFFAOYSA-N
• INCHI: 1S/C8H14O2/c1-2-10-8-5-3-7(9)4-6-8/h8H,2-6H2,1H3
• Isomeri SMILES: CCOC1CCC(=O)CC1
• Peso molecolare: 142.20
• Reaxy-Rn: 2352731
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2352731&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Ketones
          • Level6 Cyclic ketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones
• Direct Parent: Cyclic ketones
• Alternative Parents: Dialkyl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclic ketone - Ether - Dialkyl ether - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety.
• 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

Proprietà chimiche e fisiche

• Peso molecolare: 142.200 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 142.099 Da
• Monoisotopic Mass: 142.099 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 110.000
• 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