Dichloroacetyl chloride - ≥98% , CAS No.79-36-7

CAS: 79-36-7 Cat. No.: D106078 Formula: C₂HCl₃O Peso molecolare: 147.39 Beilstein Registry Number: 1209426 Numero EC: 201-199-9

GRADE & PURITY ≥98%

Synonyms

UNII-52O60099FY | Dichloroethanoyl chloride | EINECS 201-199-9 | EN300-20015 | BRN 1209426 | UN 1765 | Dichloracetyl chloride | Epitope ID:137344 | .alpha.,.alpha.-Dichloroacetyl chloride | Dichloroacetyl chloride [UN1765] [Corrosive] | DTXCID004965 | CH

Storage

Room temperature,Argon charged,Desiccated

Shipped In

FedEx DG Service

Specifications

Sinonimi

UNII-52O60099FY | Dichloroethanoyl chloride | EINECS 201-199-9 | EN300-20015 | BRN 1209426 | UN 1765 | Dichloracetyl chloride | Epitope ID:137344 | .alpha.,.alpha.-Dichloroacetyl chloride | Dichloroacetyl chloride [UN1765] [Corrosive] | DTXCID004965 | CH

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Room temperature,Argon charged,Desiccated

Spedito in

FedEx DG Service

Purezza

≥98%

Nomi e identificatori

• Pubchem Sid: 508812168
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508812168
• Sorrisi canonici: C(C(=O)Cl)(Cl)Cl
• IUPAC Name: 2,2-dichloroacetyl chloride
• InChIKey: FBCCMZVIWNDFMO-UHFFFAOYSA-N
• INCHI: 1S/C2HCl3O/c3-1(4)2(5)6/h1H
• Isomeri SMILES: C(C(=O)Cl)(Cl)Cl
• WGK Germania: 2
• RTECS: AO6650000
• Numero UN: 1765
• Gruppo di imballaggio: II
• Peso molecolare: 147.39
• Beilstein: 1209426
• Reaxy-Rn: 1209426
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1209426&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Acyl halides
      • Subclass Acyl chlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Acyl halides
• Subclass: Acyl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Acyl chlorides
• Alternative Parents: Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Carbonyl group - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as acyl chlorides. These are organic compounds containing the functional group -CO-Cl.
• External Descriptors: acyl chloride

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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in Ether
• Sensibilità: Moisture sensitive
• Indice di rifrazione: 1.4591
• Punto di ebollizione (°C): 107-108°C
• Peso molecolare: 147.380 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 145.909 Da
• Monoisotopic Mass: 145.909 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 59.800
• 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