bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane

C6Cu2F12 — CID 14617678

IUPACbis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane
SMILESF[C-](F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)[C-](F)F.[Cu+].[Cu+]
InChIInChI=1S/C6F12.2Cu/c7-1(8)3(11,12)5(15,16)6(17,18)4(13,14)2(9)10;;/q-2;2*+1
InChIKeyAFZDFJLOSOCWSD-UHFFFAOYSA-N
MW427.13 g/mol
LogP4.38
Rot. Bonds5

About bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane

bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane (PubChem CID 14617678) has the molecular formula C6Cu2F12 and a molecular weight of 427.13 g/mol. Its IUPAC name is bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane.

Molecular Properties

Compound Namebis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane
PubChem CID14617678
Molecular FormulaC6Cu2F12
Molecular Weight427.13 g/mol
Exact Mass425.84
IUPAC Namebis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane
SMILESF[C-](F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)[C-](F)F.[Cu+].[Cu+]
InChIInChI=1S/C6F12.2Cu/c7-1(8)3(11,12)5(15,16)6(17,18)4(13,14)2(9)10;;/q-2;2*+1
InChIKeyAFZDFJLOSOCWSD-UHFFFAOYSA-N
XLogP4.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.13
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane?
The IUPAC name of bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane (CID 14617678) is bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane.
What is the SMILES notation for bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane?
The canonical SMILES for bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane is F[C-](F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)[C-](F)F.[Cu+].[Cu+].
What is the InChIKey of bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane?
The InChIKey is AFZDFJLOSOCWSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F12.2Cu/c7-1(8)3(11,12)5(15,16)6(17,18)4(13,14)2(9)10;;/q-2;2*+1.
What are the key properties of bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane?
bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane has a molecular weight of 427.13 g/mol, XLogP of 4.38, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(copper(1+));1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane is sourced from PubChem (CID 14617678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).