Triphosgene - ≥99% , CAS No.32315-10-9

CAS: 32315-10-9 Cat. No.: T103041 Fórmula: C₃Cl₆O₃ Peso molecular: 296.75 Beilstein Registry Number: 1787583 Número CE: 250-986-3 PubChem CID: 94429

GRADE & PURITY ≥99%

Synonyms

AKOS005721144 | EINECS 250-986-3 | Methanol, trichloro-, carbonate (2:1) | T1467 | 2-Propen-1-ol, 3-phenyl-, benzoate, (E)- | SCHEMBL5427 | 2-styrylbenzimidazole | Bis(trichloromethyl) carbonate, purum, >=99.0% (AT) | J-018701 | D97673 | Q421346 | (2E)-3-

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice,FedEx DG Service

Visão geral

Solid phosgene substitute for a variety of applications, including the one-pot preparation of allyl azides from allyl alcohols and sodium azide, and the preparation of the esterification coupling reagent, di-2-thienyl carbonate, from 2(5H)-thiophenone. Used in the preparation of 2-chloronicotinaldehydes via cyclization of the corresponding enamides. Useful substitute for phosgene.

Specifications

Sinónimos

AKOS005721144 | EINECS 250-986-3 | Methanol, trichloro-, carbonate (2:1) | T1467 | 2-Propen-1-ol, 3-phenyl-, benzoate, (E)- | SCHEMBL5427 | 2-styrylbenzimidazole | Bis(trichloromethyl) carbonate, purum, >=99.0% (AT) | J-018701 | D97673 | Q421346 | (2E)-3-

Especificações e pureza

≥99%

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice,FedEx DG Service

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥99%

Nomes e identificadores

• Pubchem Sid: 508811462
• Sorrisos canónicos: C(=O)(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl
• IUPAC Name: bis(trichloromethyl) carbonate
• InChIKey: UCPYLLCMEDAXFR-UHFFFAOYSA-N
• INCHI: 1S/C3Cl6O3/c4-2(5,6)11-1(10)12-3(7,8)9
• SMILES isoméricas: C(=O)(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl
• WGK Alemanha: 2
• PubChem CID: 94429
• Número UN: 2928
• Grupo de embalagem: II
• Peso molecular: 296.75
• Beilstein: 1787583
• Reaxy-Rn: 1787583

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: Trihalomethanes Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carbonic acid diester - Trihalomethane - Organic oxygen compound - Organic oxide - Halomethane - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descrição: 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

Propriedades químicas e físicas

• Solubilidade: Soluble in ether, ethanol, tetrahydrofuran, benzene, cyclohexane, chloroform, hexane, carbon tetrachloride, dichloromethane and chlorobenzene. Insoluble in water.
• Sensibilidade: heat sensitive; light sensitive;Moisture sensitive
• Ponto de ebulição (°C): 205-206°C
• Ponto de fusão (°C): 79-81°C
• Peso molecular: 296.700 g/mol
• XLogP3: 4.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 295.795 Da
• Monoisotopic Mass: 293.798 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 150.000
• 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