2,6-Dichlorostyrene(stabilized with TBC) - ≥99% , CAS No.28469-92-3

CAS: 28469-92-3 Cat. No.: D474285 Summenformel: C₈H₆Cl₂ Molekulargewicht: 173.03 EG-Nummer: 249-039-7

GRADE & PURITY ≥99%

Synonyms

NSC 89716 | 1,3-Dichloro-2-vinylbenzene | EINECS 249-039-7 | FT-0638787 | CL-0056 | AKOS009156694 | FT-0610635 | FT-0686402 | 2,6-DICHLOROSTYRENE | MFCD00000579 | NXL6EU26UL | InChI=1/C8H6Cl2/c1-2-6-7(9)4-3-5-8(6)10/h2-5H,1H | UNII-NXL6EU26UL | 1,3-dichlo

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyme

NSC 89716 | 1,3-Dichloro-2-vinylbenzene | EINECS 249-039-7 | FT-0638787 | CL-0056 | AKOS009156694 | FT-0610635 | FT-0686402 | 2,6-DICHLOROSTYRENE | MFCD00000579 | NXL6EU26UL | InChI=1/C8H6Cl2/c1-2-6-7(9)4-3-5-8(6)10/h2-5H,1H | UNII-NXL6EU26UL | 1,3-dichlo

Spezifikationen & Reinheit

≥99%

Storage

Store at 2-8°C

Verschickt in

Wet ice

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

Reinheit

≥99%

Namen und Kennungen

• Pubchem Sid: 504753521
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504753521
• Kanonisches Lächeln: C=CC1=C(C=CC=C1Cl)Cl
• IUPAC Name: 1,3-dichloro-2-ethenylbenzene
• InChIKey: YJCVRMIJBXTMNR-UHFFFAOYSA-N
• INCHI: 1S/C8H6Cl2/c1-2-6-7(9)4-3-5-8(6)10/h2-5H,1H2
• Isomere SMILES: C=CC1=C(C=CC=C1Cl)Cl
• Molekulargewicht: 173.03
• Reaxy-Rn: 1931527
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1931527&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 - 1,3-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

• Löslichkeit: Immiscible with water.
• Brechungsindex: n20/D 1.574 (lit.)
• Flammpunkt (°F): 159°F
• Flammpunkt (°C): 71°
• Siedepunkt (°C): 88-90 °C/8 mmHg (lit.)
• Molekulargewicht: 173.040 g/mol
• XLogP3: 4.000
• 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: 112.000
• 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