lithium;sodium;butane;cyclohexane

C10H20LiNa — CID 173047102

IUPAClithium;sodium;butane;cyclohexane
SMILES[CH-]1CCCCC1.[CH2-]CCC.[Li+].[Na+]
InChIInChI=1S/C6H11.C4H9.Li.Na/c1-2-4-6-5-3-1;1-3-4-2;;/h1H,2-6H2;1,3-4H2,2H3;;/q2*-1;2*+1
InChIKeyJDMIYJZAPQJXHT-UHFFFAOYSA-N
MW170.20 g/mol
LogP-2.22
Rot. Bonds1

About lithium;sodium;butane;cyclohexane

lithium;sodium;butane;cyclohexane (PubChem CID 173047102) has the molecular formula C10H20LiNa and a molecular weight of 170.20 g/mol. Its IUPAC name is lithium;sodium;butane;cyclohexane.

Molecular Properties

Compound Namelithium;sodium;butane;cyclohexane
PubChem CID173047102
Molecular FormulaC10H20LiNa
Molecular Weight170.20 g/mol
Exact Mass170.16
IUPAC Namelithium;sodium;butane;cyclohexane
SMILES[CH-]1CCCCC1.[CH2-]CCC.[Li+].[Na+]
InChIInChI=1S/C6H11.C4H9.Li.Na/c1-2-4-6-5-3-1;1-3-4-2;;/h1H,2-6H2;1,3-4H2,2H3;;/q2*-1;2*+1
InChIKeyJDMIYJZAPQJXHT-UHFFFAOYSA-N
XLogP-2.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.20
LogP ≤ 5-2.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium;sodium;butane;cyclohexane?
The IUPAC name of lithium;sodium;butane;cyclohexane (CID 173047102) is lithium;sodium;butane;cyclohexane.
What is the SMILES notation for lithium;sodium;butane;cyclohexane?
The canonical SMILES for lithium;sodium;butane;cyclohexane is [CH-]1CCCCC1.[CH2-]CCC.[Li+].[Na+].
What is the InChIKey of lithium;sodium;butane;cyclohexane?
The InChIKey is JDMIYJZAPQJXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11.C4H9.Li.Na/c1-2-4-6-5-3-1;1-3-4-2;;/h1H,2-6H2;1,3-4H2,2H3;;/q2*-1;2*+1.
What are the key properties of lithium;sodium;butane;cyclohexane?
lithium;sodium;butane;cyclohexane has a molecular weight of 170.20 g/mol, XLogP of -2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;sodium;butane;cyclohexane is sourced from PubChem (CID 173047102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).