ethane;thorium(4+)

C8H20Th — CID 154147989

IUPACethane;thorium(4+)
SMILES[CH2-]C.[CH2-]C.[CH2-]C.[CH2-]C.[Th+4]
InChIInChI=1S/4C2H5.Th/c4*1-2;/h4*1H2,2H3;/q4*-1;+4
InChIKeyLJJJPESZFHSHOR-UHFFFAOYSA-N
MW348.29 g/mol
LogP3.36
Rot. Bonds

About ethane;thorium(4+)

ethane;thorium(4+) (PubChem CID 154147989) has the molecular formula C8H20Th and a molecular weight of 348.29 g/mol. Its IUPAC name is ethane;thorium(4+).

Molecular Properties

Compound Nameethane;thorium(4+)
PubChem CID154147989
Molecular FormulaC8H20Th
Molecular Weight348.29 g/mol
Exact Mass348.19
IUPAC Nameethane;thorium(4+)
SMILES[CH2-]C.[CH2-]C.[CH2-]C.[CH2-]C.[Th+4]
InChIInChI=1S/4C2H5.Th/c4*1-2;/h4*1H2,2H3;/q4*-1;+4
InChIKeyLJJJPESZFHSHOR-UHFFFAOYSA-N
XLogP3.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.29
LogP ≤ 53.36
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 ethane;thorium(4+)?
The IUPAC name of ethane;thorium(4+) (CID 154147989) is ethane;thorium(4+).
What is the SMILES notation for ethane;thorium(4+)?
The canonical SMILES for ethane;thorium(4+) is [CH2-]C.[CH2-]C.[CH2-]C.[CH2-]C.[Th+4].
What is the InChIKey of ethane;thorium(4+)?
The InChIKey is LJJJPESZFHSHOR-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H5.Th/c4*1-2;/h4*1H2,2H3;/q4*-1;+4.
What are the key properties of ethane;thorium(4+)?
ethane;thorium(4+) has a molecular weight of 348.29 g/mol, XLogP of 3.36, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;thorium(4+) is sourced from PubChem (CID 154147989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).