1,4-diiodooctafluorobutane

Synonyms: "octafluoro-1,4-diiodobutane", "1,1,2,2,3,3,4,4-octafluoro-1,4-diiodobutane", "perfluoro-1,4-diiodobutane", "1,4-diiodo octafluorobutane".

Source: 1,4-diiodooctafluorobutane is used in the synthesis of polymers.

Identifiers:

IUPAC Name: 1,1,2,2,3,3,4,4-octafluoro-1,4-diiodobutane
CAS Number: 375-50-8
PubChem ID: 78993
InChiKey: JILAKKYYZPDQBE-UHFFFAOYSA-N
Canonical SMILES: C(C(C(F)(F)I)(F)F)(C(F)(F)I)(F)F

Structural Properties:

Molecular Formula: C₄F₈I₂
Molecular Weight: 453.840

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 8
Number of atoms different from hydrogen: 14

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Wang C, Wang T, Liu W, Ruan T, Zhou Q, Liu J, Zhang A, Zhao B, Jiang G. 2012. The in vitro estrogenic activities of polyfluorinated iodine alkanes. Environ Health Perspect 120(1):119-125. DOI: 10.1289/ehp.1103773. URL: https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3261944/.