cerium;heptahydrate

H14Ce5O7 — CID 173393169

IUPACcerium;heptahydrate
SMILESO.O.O.O.O.O.O.[Ce].[Ce].[Ce].[Ce].[Ce]
InChIInChI=1S/5Ce.7H2O/h;;;;;7*1H2
InChIKeyFNSBFWXIAJBEFT-UHFFFAOYSA-N
MW826.68 g/mol
LogP-5.77
Rot. Bonds

About cerium;heptahydrate

cerium;heptahydrate (PubChem CID 173393169) has the molecular formula H14Ce5O7 and a molecular weight of 826.68 g/mol. Its IUPAC name is cerium;heptahydrate.

Molecular Properties

Compound Namecerium;heptahydrate
PubChem CID173393169
Molecular FormulaH14Ce5O7
Molecular Weight826.68 g/mol
Exact Mass825.60
IUPAC Namecerium;heptahydrate
SMILESO.O.O.O.O.O.O.[Ce].[Ce].[Ce].[Ce].[Ce]
InChIInChI=1S/5Ce.7H2O/h;;;;;7*1H2
InChIKeyFNSBFWXIAJBEFT-UHFFFAOYSA-N
XLogP-5.77
TPSA220.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500826.68
LogP ≤ 5-5.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 174516941
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CID 175443846
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CID 172859837
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CID 173164455
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CID 657017
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CID 174926874
CID 161064088
CID 161064088

Frequently Asked Questions

What is the IUPAC name of cerium;heptahydrate?
The IUPAC name of cerium;heptahydrate (CID 173393169) is cerium;heptahydrate.
What is the SMILES notation for cerium;heptahydrate?
The canonical SMILES for cerium;heptahydrate is O.O.O.O.O.O.O.[Ce].[Ce].[Ce].[Ce].[Ce].
What is the InChIKey of cerium;heptahydrate?
The InChIKey is FNSBFWXIAJBEFT-UHFFFAOYSA-N. The full InChI is InChI=1S/5Ce.7H2O/h;;;;;7*1H2.
What are the key properties of cerium;heptahydrate?
cerium;heptahydrate has a molecular weight of 826.68 g/mol, XLogP of -5.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cerium;heptahydrate is sourced from PubChem (CID 173393169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).