dilithium;ethene;ethylbenzene

C10H12Li2 — CID 174868806

IUPACdilithium;ethene;ethylbenzene
SMILESC[CH-]c1ccccc1.[H][C-]=C.[Li+].[Li+]
InChIInChI=1S/C8H9.C2H3.2Li/c1-2-8-6-4-3-5-7-8;1-2;;/h2-7H,1H3;1H,2H2;;/q2*-1;2*+1
InChIKeyMYGXVNGDPNBYFH-UHFFFAOYSA-N
MW146.09 g/mol
LogP-3.13
Rot. Bonds1

About dilithium;ethene;ethylbenzene

dilithium;ethene;ethylbenzene (PubChem CID 174868806) has the molecular formula C10H12Li2 and a molecular weight of 146.09 g/mol. Its IUPAC name is dilithium;ethene;ethylbenzene.

Molecular Properties

Compound Namedilithium;ethene;ethylbenzene
PubChem CID174868806
Molecular FormulaC10H12Li2
Molecular Weight146.09 g/mol
Exact Mass146.13
IUPAC Namedilithium;ethene;ethylbenzene
SMILESC[CH-]c1ccccc1.[H][C-]=C.[Li+].[Li+]
InChIInChI=1S/C8H9.C2H3.2Li/c1-2-8-6-4-3-5-7-8;1-2;;/h2-7H,1H3;1H,2H2;;/q2*-1;2*+1
InChIKeyMYGXVNGDPNBYFH-UHFFFAOYSA-N
XLogP-3.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.09
LogP ≤ 5-3.13
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;ethene;ethylbenzene?
The IUPAC name of dilithium;ethene;ethylbenzene (CID 174868806) is dilithium;ethene;ethylbenzene.
What is the SMILES notation for dilithium;ethene;ethylbenzene?
The canonical SMILES for dilithium;ethene;ethylbenzene is C[CH-]c1ccccc1.[H][C-]=C.[Li+].[Li+].
What is the InChIKey of dilithium;ethene;ethylbenzene?
The InChIKey is MYGXVNGDPNBYFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9.C2H3.2Li/c1-2-8-6-4-3-5-7-8;1-2;;/h2-7H,1H3;1H,2H2;;/q2*-1;2*+1.
What are the key properties of dilithium;ethene;ethylbenzene?
dilithium;ethene;ethylbenzene has a molecular weight of 146.09 g/mol, XLogP of -3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;ethene;ethylbenzene is sourced from PubChem (CID 174868806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).