ethane-1,2-diol;lanthanum(3+);trichloride

C2H6Cl3LaO2 — CID 175383384

IUPACethane-1,2-diol;lanthanum(3+);trichloride
SMILESOCCO.[Cl-].[Cl-].[Cl-].[La+3]
InChIInChI=1S/C2H6O2.3ClH.La/c3-1-2-4;;;;/h3-4H,1-2H2;3*1H;/q;;;;+3/p-3
InChIKeyWYQSMBFHLHCAFL-UHFFFAOYSA-K
MW307.33 g/mol
LogP-10.02
Rot. Bonds1

About ethane-1,2-diol;lanthanum(3+);trichloride

ethane-1,2-diol;lanthanum(3+);trichloride (PubChem CID 175383384) has the molecular formula C2H6Cl3LaO2 and a molecular weight of 307.33 g/mol. Its IUPAC name is ethane-1,2-diol;lanthanum(3+);trichloride.

Molecular Properties

Compound Nameethane-1,2-diol;lanthanum(3+);trichloride
PubChem CID175383384
Molecular FormulaC2H6Cl3LaO2
Molecular Weight307.33 g/mol
Exact Mass305.85
IUPAC Nameethane-1,2-diol;lanthanum(3+);trichloride
SMILESOCCO.[Cl-].[Cl-].[Cl-].[La+3]
InChIInChI=1S/C2H6O2.3ClH.La/c3-1-2-4;;;;/h3-4H,1-2H2;3*1H;/q;;;;+3/p-3
InChIKeyWYQSMBFHLHCAFL-UHFFFAOYSA-K
XLogP-10.02
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 5-10.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane-1,2-diol;lanthanum(3+);trichloride?
The IUPAC name of ethane-1,2-diol;lanthanum(3+);trichloride (CID 175383384) is ethane-1,2-diol;lanthanum(3+);trichloride.
What is the SMILES notation for ethane-1,2-diol;lanthanum(3+);trichloride?
The canonical SMILES for ethane-1,2-diol;lanthanum(3+);trichloride is OCCO.[Cl-].[Cl-].[Cl-].[La+3].
What is the InChIKey of ethane-1,2-diol;lanthanum(3+);trichloride?
The InChIKey is WYQSMBFHLHCAFL-UHFFFAOYSA-K. The full InChI is InChI=1S/C2H6O2.3ClH.La/c3-1-2-4;;;;/h3-4H,1-2H2;3*1H;/q;;;;+3/p-3.
What are the key properties of ethane-1,2-diol;lanthanum(3+);trichloride?
ethane-1,2-diol;lanthanum(3+);trichloride has a molecular weight of 307.33 g/mol, XLogP of -10.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane-1,2-diol;lanthanum(3+);trichloride is sourced from PubChem (CID 175383384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).