dilithium;ethene;octane

C10H20Li2 — CID 174858869

IUPACdilithium;ethene;octane
SMILES[CH2-]CCCCCCC.[H][C-]=C.[Li+].[Li+]
InChIInChI=1S/C8H17.C2H3.2Li/c1-3-5-7-8-6-4-2;1-2;;/h1,3-8H2,2H3;1H,2H2;;/q2*-1;2*+1
InChIKeySQFZFYADKYINKT-UHFFFAOYSA-N
MW154.15 g/mol
LogP-2.21
Rot. Bonds5

About dilithium;ethene;octane

dilithium;ethene;octane (PubChem CID 174858869) has the molecular formula C10H20Li2 and a molecular weight of 154.15 g/mol. Its IUPAC name is dilithium;ethene;octane.

Molecular Properties

Compound Namedilithium;ethene;octane
PubChem CID174858869
Molecular FormulaC10H20Li2
Molecular Weight154.15 g/mol
Exact Mass154.19
IUPAC Namedilithium;ethene;octane
SMILES[CH2-]CCCCCCC.[H][C-]=C.[Li+].[Li+]
InChIInChI=1S/C8H17.C2H3.2Li/c1-3-5-7-8-6-4-2;1-2;;/h1,3-8H2,2H3;1H,2H2;;/q2*-1;2*+1
InChIKeySQFZFYADKYINKT-UHFFFAOYSA-N
XLogP-2.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.15
LogP ≤ 5-2.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

zinc;dodecane;ethene
CID 140538317
lithium tridecane
CID 11321439
lithium heptadecane
CID 12950399
lithium;copper(1+);bis(decane)
CID 10937095
heptadecane
CID 156905849
dilithium;carbanide;hexane
CID 174334686
cerium;dodecane
CID 154114371
dodecane;zirconium
CID 148549415
zinc heptane
CID 4204916
bis(octane);zinc
CID 175041964
manganese;tetradecane
CID 173260191
sodium tritriacontane
CID 150964196

Frequently Asked Questions

What is the IUPAC name of dilithium;ethene;octane?
The IUPAC name of dilithium;ethene;octane (CID 174858869) is dilithium;ethene;octane.
What is the SMILES notation for dilithium;ethene;octane?
The canonical SMILES for dilithium;ethene;octane is [CH2-]CCCCCCC.[H][C-]=C.[Li+].[Li+].
What is the InChIKey of dilithium;ethene;octane?
The InChIKey is SQFZFYADKYINKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17.C2H3.2Li/c1-3-5-7-8-6-4-2;1-2;;/h1,3-8H2,2H3;1H,2H2;;/q2*-1;2*+1.
What are the key properties of dilithium;ethene;octane?
dilithium;ethene;octane has a molecular weight of 154.15 g/mol, XLogP of -2.21, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;ethene;octane is sourced from PubChem (CID 174858869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).