cerium;cyclooctatetraene

C8H8Ce — CID 159307386

IUPACcerium;cyclooctatetraene
SMILESC1=CC=CC=CC=C1.[Ce]
InChIInChI=1S/C8H8.Ce/c1-2-4-6-8-7-5-3-1;/h1-8H;
InChIKeyLCBYXZOYOUBUTB-UHFFFAOYSA-N
MW244.27 g/mol
LogP2.22
Rot. Bonds

About cerium;cyclooctatetraene

cerium;cyclooctatetraene (PubChem CID 159307386) has the molecular formula C8H8Ce and a molecular weight of 244.27 g/mol. Its IUPAC name is cerium;cyclooctatetraene.

Molecular Properties

Compound Namecerium;cyclooctatetraene
PubChem CID159307386
Molecular FormulaC8H8Ce
Molecular Weight244.27 g/mol
Exact Mass243.97
IUPAC Namecerium;cyclooctatetraene
SMILESC1=CC=CC=CC=C1.[Ce]
InChIInChI=1S/C8H8.Ce/c1-2-4-6-8-7-5-3-1;/h1-8H;
InChIKeyLCBYXZOYOUBUTB-UHFFFAOYSA-N
XLogP2.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cerium;cyclooctatetraene?
The IUPAC name of cerium;cyclooctatetraene (CID 159307386) is cerium;cyclooctatetraene.
What is the SMILES notation for cerium;cyclooctatetraene?
The canonical SMILES for cerium;cyclooctatetraene is C1=CC=CC=CC=C1.[Ce].
What is the InChIKey of cerium;cyclooctatetraene?
The InChIKey is LCBYXZOYOUBUTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8.Ce/c1-2-4-6-8-7-5-3-1;/h1-8H;.
What are the key properties of cerium;cyclooctatetraene?
cerium;cyclooctatetraene has a molecular weight of 244.27 g/mol, XLogP of 2.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cerium;cyclooctatetraene is sourced from PubChem (CID 159307386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).