Cloruro de diclorometilendimetiliminio - ≥95%(T) , CAS No.33842-02-3

CAS: 33842-02-3 Cat. No.: D155316 Peso molecular: 162.44 Número EC: 251-695-4

GRADE & PURITY ≥95%(T)

Synonyms

MFCD00011870 | N-dichloromethylene-N,N-dimethylammonium chloride | N-(dichloromethylene)-N-methylmethanaminium chloride | LS-12960 | Dichloromethylene(dimethyl)ammonium chloride | AKOS015913622 | Methanaminium, N-(dichloromethylene)-N-methyl-, chloride |

Storage

Conservar a 2-8°C,cargado con argón

Shipped In

Hielo húmedo

Descripción general

El cloruro de diclorometilen-dimetiliminio (reactivo de Vilsmeier) reacciona con o-acetaminofenoles en condiciones de Meth-Cohn para producir 2-formilpirido[2,1-b]benzoxazoles。

Specifications

Sinónimos

MFCD00011870 | N-dichloromethylene-N, N-dimethylammonium chloride | N-(dichloromethylene)-N-methylmethanaminium chloride | LS-12960 | Dichloromethylene(dimethyl)ammonium chloride | AKOS015913622 | Methanaminium, N-(dichloromethylene)-N-methyl-, chloride |

Especificaciones y pureza

≥95%(T)

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C, cargado con argón

Enviado en

Hielo húmedo

Pureza

≥95%(T)

Nombres e identificadores

• Pubchem Sid: 488192224
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488192224
• Sonrisas canónicas: C[N+](=C(Cl)Cl)C.[Cl-]
• IUPAC Name: dichloromethylidene(dimethyl)azanium;chloride
• InChIKey: NRNFKRFWZQQDMD-UHFFFAOYSA-M
• INCHI: 1S/C3H6Cl2N.ClH/c1-6(2)3(4)5;/h1-2H3;1H/q+1;/p-1
• Isómeros SMILES: C[N+](=C(Cl)Cl)C.[Cl-]
• Peso molecular: 162.44
• Reaxy-Rn: 4157987
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4157987&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Isocyanide dichlorides

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Isocyanide dichlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Isocyanide dichlorides
• Alternative Parents: Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organochlorides Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Isocyanide dichloride - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organochloride - Organohalogen compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as isocyanide dichlorides. These are organonitrogen compounds derived from isocyanide, with the general formula RN=C(Cl)Cl (R = organyl).
• 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: Slightly soluble in chloroform
• Sensibilidad: Moisture sensitive.
• Punto de fusión (°C): 183-187 °C
• Peso molecular: 162.440 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 160.957 Da
• Monoisotopic Mass: 160.957 Da
• Topological Polar Surface Area: 3.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 68.900
• 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: 2

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