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

CAS: 497-26-7 Cat. No.: M157785 Formule: C₄H₈O₂ Poids moléculaire: 88.11 Beilstein Registry Number: 102520 Numéro CE: 207-841-4

QUALITÉ & PURETÉ ≥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

Vue d’ensemble

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.

Spécifications

Synonymes

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

Spécifications et pureté

≥98%(GC)

Conditions de stockage de stockage

Room temperature,Desiccated

Expédié en

Normal

Pureté

≥98%(GC)

Noms et identifiants

Pubchem Sid

504751934

Pubchem Sid Url

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

Sourires canoniques

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

Isomères SMILES

CC1OCCO1

WGK Allemagne

2

RTECS

JI3509000

Poids moléculaire

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
    • Classe Dioxolanes
      • Subclass 1,3-dioxolanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: 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
• Description: 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

Propriétés chimiques et physiques

• Solubilité: Solubility in water: Completely miscible
• Sensibilité: Air Sensitive,Hygroscopic
• Indice de réfraction: 1.4
• Point d'éclair (°F): 28.4 °F
• Point d'éclair (°C): -2 °C
• Point d'ébullition (°C): 83 °C
• Poids moléculaire: 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