1,6-Dioxaspiro[2.5]octane - ≥95% , CAS No.185-72-8

CAS: 185-72-8 Cat. No.: D191739 Summenformel: C₆H₁₀O₂ Molekulargewicht: 114.14 EG-Nummer: 606-058-9

GRADE & PURITY ≥95%

Synonyms

BB 0304014 | 1,6-dioxaspiro[2.5]octane | 1,6-dioxa-spiro[2.5]octane | J-011909 | BRN 0103629 | DTXSID10171694 | DMADJUKSPHZYSK-UHFFFAOYSA-N | 1,6-Dioxaspiro(2.5)octane | Z1020679958 | 1,6-dioxaspiro[2,5]octane | A880703 | Tetrahydrospiro[oxirane-2,4'-[4H]

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

BB 0304014 | 1,6-dioxaspiro[2.5]octane | 1,6-dioxa-spiro[2.5]octane | J-011909 | BRN 0103629 | DTXSID10171694 | DMADJUKSPHZYSK-UHFFFAOYSA-N | 1,6-Dioxaspiro(2.5)octane | Z1020679958 | 1,6-dioxaspiro[2,5]octane | A880703 | Tetrahydrospiro[oxirane-2,4'-[4H]

Spezifikationen & Reinheit

≥95%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

528753884

Kanonisches Lächeln

C1COCCC12CO2

IUPAC Name

1,6-dioxaspiro[2.5]octane

InChIKey

DMADJUKSPHZYSK-UHFFFAOYSA-N

INCHI

1S/C6H10O2/c1-3-7-4-2-6(1)5-8-6/h1-5H2

Isomere SMILES

C1COCCC12CO2

Molekulargewicht

114.14

Reaxy-Rn

103629

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=103629&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Oxanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Oxanes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Oxanes
• Alternative Parents: Oxacyclic compounds Epoxides Dialkyl ethers Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Oxane - Oxacycle - Ether - Oxirane - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as oxanes. These are compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 114.140 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 114.068 Da
• Monoisotopic Mass: 114.068 Da
• Topological Polar Surface Area: 21.800 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 94.700
• 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