chloroprene
Synonyms: "chlorobutadiene", "2-chloro-1,3-butadiene", "2-chlorobuta-1,3-diene", "2-chlorobutadiene", "neoprene", "polychloroprene", "chloropreen", "cloroprene"
Source: chloroprene is used almost exclusively in the production of the specialized elastomer known as polychloroprene.
Identifiers:
IUPAC Name: 2-chlorobuta-1,3-diene
CAS Number: 126-99-8
PubChem ID: 31369
InChiKey: YACLQRRMGMJLJV-UHFFFAOYSA-N
Canonical SMILES: C=CC(=C)Cl
Structural Properties:
Molecular Formula: C4H5Cl
Molecular Weight: 88.536
Pharmacophore Features:
Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 5
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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)
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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors
Sanotskii IV. 1976. Aspects of the toxicology of chloroprene: immediate and long-term effects. Environ Health Perspect 17:85-93.
External Links
2D-structure
3D-structure
