3,4-Dichlorostyrene - ≥95%, stabilized with MEHQ , CAS No.2039-83-0

CAS: 2039-83-0 Cat. No.: D191949 Summenformel: C₈H₆Cl₂ Molekulargewicht: 173.04 EG-Nummer: 218-023-1

GRADE & PURITY ≥95%, stabilized with MEHQ

Synonyms

SCHEMBL14890 | DTXSID00174331 | EN300-177632 | 1,2-dichloro-4-ethenylbenzene | AKOS006283294 | 1,2-Dichloro-4-vinylbenzene | EINECS 218-023-1 | 1,2-Dichloro-4-vinylbenzene # | 3,4-dichlorophenylethylene | 3,4-Dichlorostyrene | 3,4-dichloro-styrene | SY039

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

SCHEMBL14890 | DTXSID00174331 | EN300-177632 | 1,2-dichloro-4-ethenylbenzene | AKOS006283294 | 1,2-Dichloro-4-vinylbenzene | EINECS 218-023-1 | 1,2-Dichloro-4-vinylbenzene # | 3,4-dichlorophenylethylene | 3,4-Dichlorostyrene | 3,4-dichloro-styrene | SY039

Spezifikationen & Reinheit

≥95%, stabilized with MEHQ

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥95%

Namen und Kennungen

Kanonisches Lächeln

C=CC1=CC(=C(C=C1)Cl)Cl

IUPAC Name

1,2-dichloro-4-ethenylbenzene

InChIKey

BJQFWAQRPATHTR-UHFFFAOYSA-N

INCHI

1S/C8H6Cl2/c1-2-6-3-4-7(9)8(10)5-6/h2-5H,1H2

Isomere SMILES

C=CC1=CC(=C(C=C1)Cl)Cl

Molekulargewicht

173.04

Reaxy-Rn

2039606

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2039606&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Ebene5 Chlorobenzenes
          • Ebene6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Chlorobenzenes
• Direct Parent: Dichlorobenzenes
• Alternative Parents: Styrenes Aryl chlorides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Styrene - 1,2-dichlorobenzene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 173.040 g/mol
• XLogP3: 4.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 171.985 Da
• Monoisotopic Mass: 171.985 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 122.000
• 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