2-Chlorophenylacetyl Chloride - ≥98%(GC) , CAS No.51512-09-5

CAS: 51512-09-5 Cat. No.: C153892 Peso molecular: 189.04 Número EC: 805-785-0

GRADE & PURITY ≥98%(GC)

Synonyms

2-CHLOROPHENYLACETYL CHLORIDE | 2-chloro-phenylacetyl chloride | 2-chlorophenyl-acetyl chloride | MFCD00130223 | BCA51209 | 2-Chlorophenylacetyl Chloride (stabilized with Copper chip) | 2-ChlorophenylacetylChloride(stabilizedwithCopperchip) | C2504 | SCHE

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

2-CHLOROPHENYLACETYL CHLORIDE | 2-chloro-phenylacetyl chloride | 2-chlorophenyl-acetyl chloride | MFCD00130223 | BCA51209 | 2-Chlorophenylacetyl Chloride (stabilized with Copper chip) | 2-ChlorophenylacetylChloride(stabilizedwithCopperchip) | C2504 | SCHE

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

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

Pureza

≥98%(GC)

Nombres e identificadores

• Sonrisas canónicas: C1=CC=C(C(=C1)CC(=O)Cl)Cl
• IUPAC Name: 2-(2-chlorophenyl)acetyl chloride
• InChIKey: WIHSAOYVGKVRJX-UHFFFAOYSA-N
• INCHI: 1S/C8H6Cl2O/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2
• Isómeros SMILES: C1=CC=C(C(=C1)CC(=O)Cl)Cl
• Peso molecular: 189.04
• Reaxy-Rn: 775901
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=775901&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Chlorobenzenes
• Alternative Parents: Aryl chlorides Acyl chlorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Chlorobenzene - Aryl halide - Aryl chloride - Acyl halide - Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
• 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: Light Sensitive,Moisture Sensitive,Heat Sensitive
• Índice de refracción: 1.55
• Punto de inflamación (°C): 103 °C
• Punto de ebullición (°C): 121°C/12mmHg(lit.)
• Peso molecular: 189.040 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 187.98 Da
• Monoisotopic Mass: 187.98 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 147.000
• 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