Propionyl chloride - Purifed,≥98% , CAS No.79-03-8

CAS: 79-03-8 Cat. No.: P1520089 Peso molecular: 92.52 Beilstein Registry Number: 385632 Número EC: 201-170-0

GRADE & PURITY Purifed, ≥98%

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Especificaciones y pureza

Purifed, ≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged

Enviado en

FedEx DG Service

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Grado

Purifed

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CCC(=O)Cl
• IUPAC Name: propanoyl chloride
• InChIKey: RZWZRACFZGVKFM-UHFFFAOYSA-N
• INCHI: 1S/C3H5ClO/c1-2-3(4)5/h2H2,1H3
• Isómeros SMILES: CCC(=O)Cl
• WGK Alemania: 1
• Número ONU: 1815
• Grupo de embalaje: II
• Peso molecular: 92.52
• Beilstein: 385632
• Reaxy-Rn: 385632
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=385632&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Acyl halides
• Subclass: Acyl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Acyl chlorides
• Alternative Parents: Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Carbonyl group - Aliphatic acyclic compound
• Descripción: 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: 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

• Sensibilidad: Moisture sensitive
• Índice de refracción: 1.4051
• Punto de inflamación (°F): 42.8 °F
• Punto de inflamación (°C): 12℃
• Punto de ebullición (°C): 80℃
• Punto de fusión (°C): -94℃
• Peso molecular: 92.520 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 92.0029 Da
• Monoisotopic Mass: 92.0029 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 42.200
• 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

Referencias

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