bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+)

C34H38F10PtTi — CID 23281684

About bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+)

bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+) (PubChem CID 23281684) has the molecular formula C34H38F10PtTi and a molecular weight of 879.60 g/mol. Its IUPAC name is bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+).

Molecular Properties

• Compound Name: bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+)
• PubChem CID: 23281684
• Molecular Formula: C34H38F10PtTi
• Molecular Weight: 879.60 g/mol
• Exact Mass: 879.19
• IUPAC Name: bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+)
• SMILES: C1CCCC1.C1CCCC1.Fc1[c-]c(F)c(F)c(F)c1F.Fc1[c-]c(F)c(F)c(F)c1F.[C-]#CC(C)(C)C.[C-]#CC(C)(C)C.[Pt+2].[Ti+2]
• InChI: InChI=1S/2C6F5.2C6H9.2C5H10.Pt.Ti/c2*7-2-1-3(8)5(10)6(11)4(2)9;2*1-5-6(2,3)4;2*1-2-4-5-3-1;;/h;;2*2-4H3;2*1-5H2;;/q4*-1;;;2*+2
• InChIKey: AFEAFJXBDBIQQA-UHFFFAOYSA-N
• XLogP: 11.51
• TPSA: 0.00 Ų
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	879.60
LogP ≤ 5	11.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+)?

The IUPAC name of bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+) (CID 23281684) is bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+).

What is the SMILES notation for bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+)?

The canonical SMILES for bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+) is C1CCCC1.C1CCCC1.Fc1[c-]c(F)c(F)c(F)c1F.Fc1[c-]c(F)c(F)c(F)c1F.[C-]#CC(C)(C)C.[C-]#CC(C)(C)C.[Pt+2].[Ti+2].

What is the InChIKey of bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+)?

The InChIKey is AFEAFJXBDBIQQA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6F5.2C6H9.2C5H10.Pt.Ti/c2*7-2-1-3(8)5(10)6(11)4(2)9;2*1-5-6(2,3)4;2*1-2-4-5-3-1;;/h;;2*2-4H3;2*1-5H2;;/q4*-1;;;2*+2.

What are the key properties of bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+)?

bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+) has a molecular weight of 879.60 g/mol, XLogP of 11.51, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for bis(cyclopentane);bis(3,3-dimethylbut-1-yne);bis(1,2,3,4,5-pentafluorobenzene-6-ide);platinum(2+);titanium(2+) is sourced from PubChem (CID 23281684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).