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

CAS: 51512-09-5 Cat. No.: C153892 Formule: C₈H₆Cl₂O Poids moléculaire: 189.04 Numéro CE: 805-785-0

QUALITÉ & PURETÉ ≥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

Spécifications

Synonymes

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

Spécifications et pureté

≥98%(GC)

Conditions de stockage de stockage

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

Expédié en

Wet ice

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

Pureté

≥98%(GC)

Noms et identifiants

Pubchem Sid

508808271

Sourires canoniques

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

Isomères SMILES

C1=CC=C(C(=C1)CC(=O)Cl)Cl

Poids moléculaire

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
    • Classe Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: 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
• Description: 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

Propriétés chimiques et physiques

• Sensibilité: Light Sensitive,Moisture Sensitive,Heat Sensitive
• Indice de réfraction: 1.55
• Point d'éclair (°C): 103 °C
• Point d'ébullition (°C): 121°C/12mmHg(lit.)
• Poids moléculaire: 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