octachlorocyclopent-1-ene

• ChemBase ID: 138925
• Molecular Formular: C5Cl8
• Molecular Mass: 343.6775
• Monoisotopic Mass: 339.75082144
• SMILES: C1(=C(C(C(C1(Cl)Cl)(Cl)Cl)(Cl)Cl)Cl)Cl
• Canonical SMILES: ClC1=C(Cl)C(C(C1(Cl)Cl)(Cl)Cl)(Cl)Cl
• InChI: InChI=1S/C5Cl8/c6-1-2(7)4(10,11)5(12,13)3(1,8)9
• InChIKey: DMZRCHJVWAKCAX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: octachlorocyclopent-1-ene
• IUPAC Traditional name: octachlorocyclopentene
• Synonyms: Octachlorocyclopentene

Database IDs

• MDL Number: MFCD00145025
• PubChem SID: 162233176
• PubChem CID: 12814

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.7032332
• LogD (pH = 7.4): 5.7032332
• Log P: 5.7032332
• Molar Refractivity: 63.266 cm^3
• Polarizability: 24.419413 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Empirical Formula (Hill Notation): C5Cl8