cerium(4+) tetrachlorate

CeCl4O12 — CID 173421704

IUPACcerium(4+) tetrachlorate
SMILES[Ce+4].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-]
InChIInChI=1S/Ce.4ClO3/c;4*2-1(3)4/q+4;4*-1
InChIKeyGVJWTFLLUGDUSP-UHFFFAOYSA-N
MW473.92 g/mol
LogP-14.27
Rot. Bonds

About cerium(4+) tetrachlorate

cerium(4+) tetrachlorate (PubChem CID 173421704) has the molecular formula CeCl4O12 and a molecular weight of 473.92 g/mol. Its IUPAC name is cerium(4+) tetrachlorate.

Molecular Properties

Compound Namecerium(4+) tetrachlorate
PubChem CID173421704
Molecular FormulaCeCl4O12
Molecular Weight473.92 g/mol
Exact Mass471.72
IUPAC Namecerium(4+) tetrachlorate
SMILES[Ce+4].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-]
InChIInChI=1S/Ce.4ClO3/c;4*2-1(3)4/q+4;4*-1
InChIKeyGVJWTFLLUGDUSP-UHFFFAOYSA-N
XLogP-14.27
TPSA276.72 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.92
LogP ≤ 5-14.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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Frequently Asked Questions

What is the IUPAC name of cerium(4+) tetrachlorate?
The IUPAC name of cerium(4+) tetrachlorate (CID 173421704) is cerium(4+) tetrachlorate.
What is the SMILES notation for cerium(4+) tetrachlorate?
The canonical SMILES for cerium(4+) tetrachlorate is [Ce+4].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-].[O-][Cl+2]([O-])[O-].
What is the InChIKey of cerium(4+) tetrachlorate?
The InChIKey is GVJWTFLLUGDUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/Ce.4ClO3/c;4*2-1(3)4/q+4;4*-1.
What are the key properties of cerium(4+) tetrachlorate?
cerium(4+) tetrachlorate has a molecular weight of 473.92 g/mol, XLogP of -14.27, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for cerium(4+) tetrachlorate is sourced from PubChem (CID 173421704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).