Polychloroprene - 85% trans, 10% cis , CAS No.9010-98-4

CAS: 9010-98-4 Cat. No.: P466846 Formule: [-CH₂CH=C(Cl)CH₂-]n Numéro CE: 618-463-8 PubChem CID: 31369

QUALITÉ & PURETÉ 85% trans, 10% cis

Synonyms

2-Cloro-1,3-butadiene [Italian]|CHLOROPRENE [IARC]|Chloroprene, uninhibited [Forbidden]|Cloroprene|Cloroprene [Italian]|2-Chlorobutadiene|CHLOROPRENE [HSDB]|Chloroprene, inhibited|Chloropreen [Dutch]|.beta.-Chlorobutadiene|2-Cloro-1,3-butadiene|CHLOROPRENE|.beta.-Chloroprene|2-Chlor-1,3-butadien|2-Chlorobuta-1,3-diene|2-Chloor-1,3-butadieen [Dutch]|2-Chloroprene|2-Chloor-1,3-butadieen|Chloropren|Chloroprene, inhibited [UN1991] [Flammable liquid, Poison]|CHLORO-1,3-BUTADIENE, 2-|Chloropren [German, Polish]|Chloropren(GERMAN, POLISH)|Chloropreen|1,3-Butadiene, 2-chloro-|2-Chlorobutadiene 1,3|2-Chlorobuta-1,3-diene;2-Chloro-1,3-butadiene;1,3-Butadiene, 2-chloro-|Chlorobutadiene|Chloroprene, uninhibited|2-Chlor-1,3-butadien [German]|2-Chloro-1,3-butadiene

Storage

Room temperature

Spécifications

Synonymes

2-Cloro-1,3-butadiene [Italian] | CHLOROPRENE [IARC] | Chloroprene, uninhibited [Forbidden] | Cloroprene | Cloroprene [Italian] | 2-Chlorobutadiene | CHLOROPRENE [HSDB] | Chloroprene, inhibited | Chloropreen [Dutch] | .beta.-Chlorobutadiene | 2-Cloro-1,3-butadiene | CHLOROPRENE | .beta.-Chloroprene | 2-Chlor-1,3-butadien | 2-Chlorobuta-1, Afficher plus

Spécifications et pureté

85% trans, 10% cis

Conditions de stockage de stockage

Room temperature

Noms et identifiants

Sourires canoniques

C=CC(=C)Cl

IUPAC Name

2-chlorobuta-1,3-diene

InChIKey

YACLQRRMGMJLJV-UHFFFAOYSA-N

INCHI

1S/C4H5Cl/c1-3-4(2)5/h3H,1-2H2

Isomères SMILES

C=CC(=C)Cl

PubChem CID

31369

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Vinyl halides
      • Subclass Vinyl chlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Vinyl halides
• Subclass: Vinyl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Vinyl chlorides
• Alternative Parents: Chloroalkenes Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Chloroalkene - Haloalkene - Vinyl chloride - Hydrocarbon derivative - Organochloride - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as vinyl chlorides. These are vinyl halides in which a chlorine atom is bonded to an sp2-hybridised carbon atom.
• External Descriptors: chloroolefin

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

Mécanismes d'action

Propriétés chimiques et physiques

• Point d'éclair (°F): Not applicable
• Point d'éclair (°C): Not applicable
• Point de fusion (°C): Tg−48℃
• Poids moléculaire: 88.530 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 88.008 Da
• Monoisotopic Mass: 88.008 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 54.700
• 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