dodecalithium;hexakis(fluoro(dioxido)borane)

B6F6Li12O12 — CID 158162682

IUPACdodecalithium;hexakis(fluoro(dioxido)borane)
SMILES[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F
InChIInChI=1S/6BFO2.12Li/c6*2-1(3)4;;;;;;;;;;;;/q6*-2;12*+1
InChIKeyFWLUTJHBRZTAMP-UHFFFAOYSA-N
MW454.14 g/mol
LogP-49.98
Rot. Bonds

About dodecalithium;hexakis(fluoro(dioxido)borane)

dodecalithium;hexakis(fluoro(dioxido)borane) (PubChem CID 158162682) has the molecular formula B6F6Li12O12 and a molecular weight of 454.14 g/mol. Its IUPAC name is dodecalithium;hexakis(fluoro(dioxido)borane).

Molecular Properties

Compound Namedodecalithium;hexakis(fluoro(dioxido)borane)
PubChem CID158162682
Molecular FormulaB6F6Li12O12
Molecular Weight454.14 g/mol
Exact Mass456.18
IUPAC Namedodecalithium;hexakis(fluoro(dioxido)borane)
SMILES[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F
InChIInChI=1S/6BFO2.12Li/c6*2-1(3)4;;;;;;;;;;;;/q6*-2;12*+1
InChIKeyFWLUTJHBRZTAMP-UHFFFAOYSA-N
XLogP-49.98
TPSA276.72 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.14
LogP ≤ 5-49.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dodecalithium;hexakis(fluoro(dioxido)borane)?
The IUPAC name of dodecalithium;hexakis(fluoro(dioxido)borane) (CID 158162682) is dodecalithium;hexakis(fluoro(dioxido)borane).
What is the SMILES notation for dodecalithium;hexakis(fluoro(dioxido)borane)?
The canonical SMILES for dodecalithium;hexakis(fluoro(dioxido)borane) is [Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.[O-]B([O-])F.
What is the InChIKey of dodecalithium;hexakis(fluoro(dioxido)borane)?
The InChIKey is FWLUTJHBRZTAMP-UHFFFAOYSA-N. The full InChI is InChI=1S/6BFO2.12Li/c6*2-1(3)4;;;;;;;;;;;;/q6*-2;12*+1.
What are the key properties of dodecalithium;hexakis(fluoro(dioxido)borane)?
dodecalithium;hexakis(fluoro(dioxido)borane) has a molecular weight of 454.14 g/mol, XLogP of -49.98, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for dodecalithium;hexakis(fluoro(dioxido)borane) is sourced from PubChem (CID 158162682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).