1,1-dichloro-2,2,3,3,4,4,5,5,6,6-decafluorocyclohexane

• ChemBase ID: 97131
• Molecular Formular: C6Cl2F10
• Molecular Mass: 332.954232
• Monoisotopic Mass: 331.92173756
• SMILES: FC1(F)C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(Cl)Cl
• Canonical SMILES: FC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(Cl)Cl)(F)F
• InChI: InChI=1S/C6Cl2F10/c7-1(8)2(9,10)4(13,14)6(17,18)5(15,16)3(1,11)12
• InChIKey: HDRXJTRBIHARLO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,1-dichloro-2,2,3,3,4,4,5,5,6,6-decafluorocyclohexane
• IUPAC Traditional name: 1,1-dichloro-2,2,3,3,4,4,5,5,6,6-decafluorocyclohexane
• Synonyms: 1,1-Dichloroperfluorocyclohexane

Database IDs

• MDL Number: MFCD01631691
• PubChem SID: 162083746
• PubChem CID: 2736850

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.0707107
• LogD (pH = 7.4): 5.0707107
• Log P: 5.0707107
• Molar Refractivity: 37.845 cm^3
• Polarizability: 15.041949 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: Irritant