dilithium;propane;propane

C6H14Li2 — CID 173095332

IUPACdilithium;propane;propane
SMILESC[CH-]C.[CH2-]CC.[Li+].[Li+]
InChIInChI=1S/2C3H7.2Li/c2*1-3-2;;/h3H,1-2H3;1,3H2,2H3;;/q2*-1;2*+1
InChIKeyXIFYDTRIAMMRPC-UHFFFAOYSA-N
MW100.06 g/mol
LogP-3.53
Rot. Bonds

About dilithium;propane;propane

dilithium;propane;propane (PubChem CID 173095332) has the molecular formula C6H14Li2 and a molecular weight of 100.06 g/mol. Its IUPAC name is dilithium;propane;propane.

Molecular Properties

Compound Namedilithium;propane;propane
PubChem CID173095332
Molecular FormulaC6H14Li2
Molecular Weight100.06 g/mol
Exact Mass100.14
IUPAC Namedilithium;propane;propane
SMILESC[CH-]C.[CH2-]CC.[Li+].[Li+]
InChIInChI=1S/2C3H7.2Li/c2*1-3-2;;/h3H,1-2H3;1,3H2,2H3;;/q2*-1;2*+1
InChIKeyXIFYDTRIAMMRPC-UHFFFAOYSA-N
XLogP-3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.06
LogP ≤ 5-3.53
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 dilithium;propane;propane?
The IUPAC name of dilithium;propane;propane (CID 173095332) is dilithium;propane;propane.
What is the SMILES notation for dilithium;propane;propane?
The canonical SMILES for dilithium;propane;propane is C[CH-]C.[CH2-]CC.[Li+].[Li+].
What is the InChIKey of dilithium;propane;propane?
The InChIKey is XIFYDTRIAMMRPC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7.2Li/c2*1-3-2;;/h3H,1-2H3;1,3H2,2H3;;/q2*-1;2*+1.
What are the key properties of dilithium;propane;propane?
dilithium;propane;propane has a molecular weight of 100.06 g/mol, XLogP of -3.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;propane;propane is sourced from PubChem (CID 173095332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).