2-Methyl-1,3-dioxolane - ≥98%(GC) , CAS No.497-26-7

CAS: 497-26-7 Cat. No.: M157785 Summenformel: C₄H₈O₂ Molekulargewicht: 88.11 Beilstein Registry Number: 102520 EG-Nummer: 207-841-4

QUALITÄT & REINHEIT ≥98%(GC)

Synonyms

AKOS005207145 | Q27271710 | SY049481 | cisdioxo | NSC 5209 | EINECS 207-841-4 | FT-0612885 | MFCD00003210 | 1,3-Dioxolane, 2-methyl- | NSC5209 | NSC-5209 | M0210 | 2-METHYL-1,3-DIOXOLANE | 2-Methyl-1,3-dioxolane, 97% | 2-Methyldioxole | Methyl-1,3-dioxola

Storage

Room temperature,Desiccated

Shipped In

Normal

Übersicht

The kinetics and mechanism of the gas-phase thermal decomposition of 2-methyl-1,3-dioxolane has been studied in a static system. The infrared spectra of solid, liquid and gaseous 2-methyl-1,3-dioxolane has been studied. Low-temperature ozonation of 2-methyl-1,3-dioxolane in acetone-d6, methyl acetate and tert-butyl methyl ether has been reported.

Spezifikationen

Synonyme

AKOS005207145 | Q27271710 | SY049481 | cisdioxo | NSC 5209 | EINECS 207-841-4 | FT-0612885 | MFCD00003210 | 1,3-Dioxolane, 2-methyl- | NSC5209 | NSC-5209 | M0210 | 2-METHYL-1,3-DIOXOLANE | 2-Methyl-1,3-dioxolane, 97% | 2-Methyldioxole | Methyl-1,3-dioxola

Spezifikationen & Reinheit

≥98%(GC)

Storage

Room temperature,Desiccated

Verschickt in

Normal

Reinheit

≥98%(GC)

Namen und Kennungen

Pubchem Sid

504751934

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751934

Kanonisches Lächeln

CC1OCCO1

IUPAC Name

2-methyl-1,3-dioxolane

InChIKey

HTWIZMNMTWYQRN-UHFFFAOYSA-N

INCHI

1S/C4H8O2/c1-4-5-2-3-6-4/h4H,2-3H2,1H3

Isomere SMILES

CC1OCCO1

WGK Deutschland

2

RTECS

JI3509000

Molekulargewicht

88.11

Beilstein

102520

Reaxy-Rn

102520

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=102520&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Dioxolanes
      • Subclass 1,3-dioxolanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Dioxolanes
• Subclass: 1,3-dioxolanes
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,3-dioxolanes
• Alternative Parents: Oxacyclic compounds Acetals Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Meta-dioxolane - Oxacycle - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as 1,3-dioxolanes. These are organic compounds containing 1,3-dioxolane, an aliphatic five-member ring with two oxygen atoms in ring positions 1 and 3.
• 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

• Löslichkeit: Solubility in water: Completely miscible
• Empfindlichkeit: Air Sensitive,Hygroscopic
• Brechungsindex: 1.4
• Flammpunkt (°F): 28.4 °F
• Flammpunkt (°C): -2 °C
• Siedepunkt (°C): 83 °C
• Molekulargewicht: 88.110 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 88.0524 Da
• Monoisotopic Mass: 88.0524 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 38.800
• 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