Carbonate d'éthylène - ≥98% , CAS No.96-49-1

CAS: 96-49-1 Cat. No.: E105727 Formule: C₃H₄O₃ Poids moléculaire: 88.06 Beilstein Registry Number: 106249 Numéro CE: 202-510-0

GRADE & PURITY ≥98%

Synonyms

Ethylene glycol, cyclic carbonate | UNII-RGJ96TB7R7 | (1,3)dioxolan-2-one | CCRIS 293 | DTXSID2026600 | J-503937 | 2-(3,4-Difluorophenoxy)propane | EC 202-510-0 | NSC16568 | NSC-16568 | ethylenecarbonate | NCGC00258628-01 | 2-Dioxolone | Ethylenester kyse

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Synonymes

Ethylene glycol, cyclic carbonate | UNII-RGJ96TB7R7 | (1,3)dioxolan-2-one | CCRIS 293 | DTXSID2026600 | J-503937 | 2-(3,4-Difluorophenoxy)propane | EC 202-510-0 | NSC16568 | NSC-16568 | ethylenecarbonate | NCGC00258628-01 | 2-Dioxolone | Ethylenester kyse

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature,Desiccated

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 508815591
• Sourires canoniques: C1COC(=O)O1
• IUPAC Name: 1,3-dioxolan-2-one
• InChIKey: KMTRUDSVKNLOMY-UHFFFAOYSA-N
• INCHI: 1S/C3H4O3/c4-3-5-1-2-6-3/h1-2H2
• Isomères SMILES: C1COC(=O)O1
• WGK Allemagne: 1
• RTECS: FF9550000
• Poids moléculaire: 88.06
• Beilstein: 106249
• Reaxy-Rn: 106249
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=106249&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Organic carbonic acids and derivatives
      • Subclass Carbonic acid diesters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Organic carbonic acids and derivatives
• Subclass: Carbonic acid diesters
• Intermediate Tree Nodes: Not available
• Direct Parent: Carbonic acid diesters
• Alternative Parents: 1,3-dioxolanes Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Carbonic acid diester - Meta-dioxolane - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as carbonic acid diesters. These are compounds comprising the carbonic acid diester functional group.
• 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 soluble
• Sensibilité: Hygroscopic.
• Point d'éclair (°C): 58.5 °C
• Point d'ébullition (°C): 243-244°C
• Point de fusion (°C): 34-37°C
• Poids moléculaire: 88.060 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 88.016 Da
• Monoisotopic Mass: 88.016 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 60.400
• 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