1,2-Dichloroethane-d4 - ≥99 atom% D , CAS No.17060-07-0

CAS: 17060-07-0 Cat. No.: D115109 Fórmula: Cl₂C₂D₄ Peso molecular: 102.98 Número EC: 627-507-5

CALIDAD & PUREZA ≥99 atom% D

Synonyms

1,2-Dichloroethane D4|1,2-Dichloroethane D4; Ethane-1,1,2,2-d4, 1,2-dichloro- (8CI,9CI); Ethane-1,1,2,2-d4, dichloro- (7CI); 1,2-Dichloroethane-d4|Ethylene-d4 dichloride|1,2-Dichloroethane-d4|Ethane-1,1,2,2-d4,1,2-dichloro-(8ci,9ci)|Ethane-1,1,2,2-d4, 1,2-dichloro-|1,2-dichloro-1,1,2,2-tetradeuterioethane

Storage

Room temperature

Shipped In

Normal

Descripción general

1,2-Dichloroethane-d4 is 1,2-dichloroethane with all the hydrogen atoms replaced by deuterium. Its synthesis and structure elucidation by neutron diffraction measurements has been reported.
Application
1,2-Dichloroethane-d4 may be used:
As a NMR solvent.
As a surrogate standard during the analysis of volatile organic compounds (VOC) in water by gas chromatography-mass spectrometry (GC-MS).
As a chain termination reagent in the synthesis of poly(ethylene-d4 oxide).

Especificaciones

Sinónimos

1,2-Dichloroethane D4 | 1,2-Dichloroethane D4; Ethane-1,1,2,2-d4, 1,2-dichloro- (8CI,9CI); Ethane-1,1,2,2-d4, dichloro- (7CI); 1,2-Dichloroethane-d4 | Ethylene-d4 dichloride | 1,2-Dichloroethane-d4 | Ethane-1,1,2,2-d4,1,2-dichloro-(8ci,9ci) | Ethane-1,1,2,2-d4, 1,2-dichloro- | 1,2-dichloro-1,1,2,2-tetradeuterioethane

Especificaciones y pureza

≥99 atom% D

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥99 atom% D

Nombres e identificadores

Pubchem Sid

508806990

Sonrisas canónicas

C(CCl)Cl

IUPAC Name

1,2-dichloro-1,1,2,2-tetradeuterioethane

InChIKey

WSLDOOZREJYCGB-LNLMKGTHSA-N

INCHI

1S/C2H4Cl2/c3-1-2-4/h1-2H2/i1D2,2D2

Isómeros SMILES

[2H]C([2H])(C([2H])([2H])Cl)Cl

WGK Alemania

3

Número ONU

1184

Peso molecular

102.98

Reaxy-Rn

605264

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605264&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Organochlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Organochlorides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organochlorides
• Alternative Parents: Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organochlorides. These are compounds containing a chemical bond between a carbon atom and a chlorine atom.
• 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

• Solubilidad: Partially miscible with water.
• Sensibilidad: Light sensitive,Hygroscopic
• Índice de refracción: 1.443
• Punto de inflamación (°F): 60.8 °F
• Punto de inflamación (°C): 16°C
• Punto de ebullición (°C): 83°C
• Punto de fusión (°C): -35°C
• Peso molecular: 102.980 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 101.994 Da
• Monoisotopic Mass: 101.994 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 6.000
• Isotope Atom Count: 4
• 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