cerium(3+);acetate;hexahydrate

C2H15CeO8+2 — CID 23158452

IUPACcerium(3+);acetate;hexahydrate
SMILESCC(=O)[O-].O.O.O.O.O.O.[Ce+3]
InChIInChI=1S/C2H4O2.Ce.6H2O/c1-2(3)4;;;;;;;/h1H3,(H,3,4);;6*1H2/q;+3;;;;;;/p-1
InChIKeyBLQAAICOAXOXNF-UHFFFAOYSA-M
MW307.25 g/mol
LogP-6.19
Rot. Bonds

About cerium(3+);acetate;hexahydrate

cerium(3+);acetate;hexahydrate (PubChem CID 23158452) has the molecular formula C2H15CeO8+2 and a molecular weight of 307.25 g/mol. Its IUPAC name is cerium(3+);acetate;hexahydrate.

Molecular Properties

Compound Namecerium(3+);acetate;hexahydrate
PubChem CID23158452
Molecular FormulaC2H15CeO8+2
Molecular Weight307.25 g/mol
Exact Mass306.98
IUPAC Namecerium(3+);acetate;hexahydrate
SMILESCC(=O)[O-].O.O.O.O.O.O.[Ce+3]
InChIInChI=1S/C2H4O2.Ce.6H2O/c1-2(3)4;;;;;;;/h1H3,(H,3,4);;6*1H2/q;+3;;;;;;/p-1
InChIKeyBLQAAICOAXOXNF-UHFFFAOYSA-M
XLogP-6.19
TPSA229.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.25
LogP ≤ 5-6.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 174049693
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Frequently Asked Questions

What is the IUPAC name of cerium(3+);acetate;hexahydrate?
The IUPAC name of cerium(3+);acetate;hexahydrate (CID 23158452) is cerium(3+);acetate;hexahydrate.
What is the SMILES notation for cerium(3+);acetate;hexahydrate?
The canonical SMILES for cerium(3+);acetate;hexahydrate is CC(=O)[O-].O.O.O.O.O.O.[Ce+3].
What is the InChIKey of cerium(3+);acetate;hexahydrate?
The InChIKey is BLQAAICOAXOXNF-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H4O2.Ce.6H2O/c1-2(3)4;;;;;;;/h1H3,(H,3,4);;6*1H2/q;+3;;;;;;/p-1.
What are the key properties of cerium(3+);acetate;hexahydrate?
cerium(3+);acetate;hexahydrate has a molecular weight of 307.25 g/mol, XLogP of -6.19, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cerium(3+);acetate;hexahydrate is sourced from PubChem (CID 23158452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).