cerium;ethanol;hydrochloride

C2H7CeClO — CID 174824805

IUPACcerium;ethanol;hydrochloride
SMILESCCO.Cl.[Ce]
InChIInChI=1S/C2H6O.Ce.ClH/c1-2-3;;/h3H,2H2,1H3;;1H
InChIKeyWDWIRVMEYGPFIU-UHFFFAOYSA-N
MW222.65 g/mol
LogP0.42
Rot. Bonds

About cerium;ethanol;hydrochloride

cerium;ethanol;hydrochloride (PubChem CID 174824805) has the molecular formula C2H7CeClO and a molecular weight of 222.65 g/mol. Its IUPAC name is cerium;ethanol;hydrochloride.

Molecular Properties

Compound Namecerium;ethanol;hydrochloride
PubChem CID174824805
Molecular FormulaC2H7CeClO
Molecular Weight222.65 g/mol
Exact Mass221.92
IUPAC Namecerium;ethanol;hydrochloride
SMILESCCO.Cl.[Ce]
InChIInChI=1S/C2H6O.Ce.ClH/c1-2-3;;/h3H,2H2,1H3;;1H
InChIKeyWDWIRVMEYGPFIU-UHFFFAOYSA-N
XLogP0.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.65
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cerium;ethanol;hydrochloride?
The IUPAC name of cerium;ethanol;hydrochloride (CID 174824805) is cerium;ethanol;hydrochloride.
What is the SMILES notation for cerium;ethanol;hydrochloride?
The canonical SMILES for cerium;ethanol;hydrochloride is CCO.Cl.[Ce].
What is the InChIKey of cerium;ethanol;hydrochloride?
The InChIKey is WDWIRVMEYGPFIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O.Ce.ClH/c1-2-3;;/h3H,2H2,1H3;;1H.
What are the key properties of cerium;ethanol;hydrochloride?
cerium;ethanol;hydrochloride has a molecular weight of 222.65 g/mol, XLogP of 0.42, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cerium;ethanol;hydrochloride is sourced from PubChem (CID 174824805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).