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

CAS: 32315-10-9 Cat. No.: T103041 Formule: C₃Cl₆O₃ Poids moléculaire: 296.75 Beilstein Registry Number: 1787583 Numéro CE: 250-986-3 PubChem CID: 94429

QUALITÉ & PURETÉ ≥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

Vue d’ensemble

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.

Spécifications

Synonymes

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-

Spécifications et pureté

≥99%

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice,FedEx DG Service

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥99%

Noms et identifiants

Pubchem Sid

508811462

Sourires canoniques

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

Isomères SMILES

C(=O)(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl

WGK Allemagne

2

PubChem CID

94429

Numéro ONU

2928

Groupe d'emballage

II

Poids moléculaire

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
• Description: 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

Propriétés chimiques et physiques

• Solubilité: Soluble in ether, ethanol, tetrahydrofuran, benzene, cyclohexane, chloroform, hexane, carbon tetrachloride, dichloromethane and chlorobenzene. Insoluble in water.
• Sensibilité: heat sensitive; light sensitive;Moisture sensitive
• Point d'ébullition (°C): 205-206°C
• Point de fusion (°C): 79-81°C
• Poids moléculaire: 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