Dimetil-d6carbonato - ≥98%,≥99 atom% D , CAS No.108481-44-3

CAS: 108481-44-3 Cat. No.: D302175 Peso molecular: 96.11 Número EC: 690-550-3

GRADE & PURITY ≥98%,≥99 atom% D

Synonyms

AMY37005 | DIMETHYL CARBONATE-D6-D | Dimethylcarbonate-d6 | Dimethyl-d6 carbonate | Dimethylcarbona | Dimethyl-d6 carbonate, 99 atom % D, 97% (CP) | Bis[(~2~H_3_)methyl] carbonate | DTXSID90679845 | F90789 | MFCD01073488 | AKOS015910282 | bis(trideuteriom

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Specifications

Sinónimos

AMY37005 | DIMETHYL CARBONATE-D6-D | Dimethylcarbonate-d6 | Dimethyl-d6 carbonate | Dimethylcarbona | Dimethyl-d6 carbonate, 99 atom % D, 97% (CP) | Bis[(~2~H_3_)methyl] carbonate | DTXSID90679845 | F90789 | MFCD01073488 | AKOS015910282 | bis(trideuteriom

Especificaciones y pureza

≥98%, ≥99 atom% D

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Pureza

≥98%, ≥99 atom% D

Nombres e identificadores

• Sonrisas canónicas: COC(=O)OC
• IUPAC Name: bis(trideuteriomethyl) carbonate
• InChIKey: IEJIGPNLZYLLBP-WFGJKAKNSA-N
• INCHI: 1S/C3H6O3/c1-5-3(4)6-2/h1-2H3/i1D3,2D3
• Isómeros SMILES: [2H]C([2H])([2H])OC(=O)OC([2H])([2H])[2H]
• CAS alternativo: 616-38-6（unlabelled）
• Número ONU: UN 1161
• Grupo de embalaje: II
• Peso molecular: 96.11
• Reaxy-Rn: 635821
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635821&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Organic carbonic acids and derivatives
• Subclass: Carbonic acid diesters
• Intermediate Tree Nodes: Not available
• Direct Parent: Carbonic acid diesters
• Alternative Parents: Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carbonic acid diester - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Punto de inflamación (°F): 60.8 °F
• Punto de inflamación (°C): 16 °C
• Punto de ebullición (°C): 90 °C
• Punto de fusión (°C): 2-4 °C
• Peso molecular: 96.110 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 96.0694 Da
• Monoisotopic Mass: 96.0694 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 44.000
• Isotope Atom Count: 6
• 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