cerium;tetrakis(propan-2-ol)

C12H32CeO4 — CID 87109563

IUPACcerium;tetrakis(propan-2-ol)
SMILESCC(C)O.CC(C)O.CC(C)O.CC(C)O.[Ce]
InChIInChI=1S/4C3H8O.Ce/c4*1-3(2)4;/h4*3-4H,1-2H3;
InChIKeyBXSSQHCSSBJNIT-UHFFFAOYSA-N
MW380.50 g/mol
LogP1.55
Rot. Bonds

About cerium;tetrakis(propan-2-ol)

cerium;tetrakis(propan-2-ol) (PubChem CID 87109563) has the molecular formula C12H32CeO4 and a molecular weight of 380.50 g/mol. Its IUPAC name is cerium;tetrakis(propan-2-ol).

Molecular Properties

Compound Namecerium;tetrakis(propan-2-ol)
PubChem CID87109563
Molecular FormulaC12H32CeO4
Molecular Weight380.50 g/mol
Exact Mass380.14
IUPAC Namecerium;tetrakis(propan-2-ol)
SMILESCC(C)O.CC(C)O.CC(C)O.CC(C)O.[Ce]
InChIInChI=1S/4C3H8O.Ce/c4*1-3(2)4;/h4*3-4H,1-2H3;
InChIKeyBXSSQHCSSBJNIT-UHFFFAOYSA-N
XLogP1.55
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.50
LogP ≤ 51.55
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cerium;tetrakis(propan-2-ol)?
The IUPAC name of cerium;tetrakis(propan-2-ol) (CID 87109563) is cerium;tetrakis(propan-2-ol).
What is the SMILES notation for cerium;tetrakis(propan-2-ol)?
The canonical SMILES for cerium;tetrakis(propan-2-ol) is CC(C)O.CC(C)O.CC(C)O.CC(C)O.[Ce].
What is the InChIKey of cerium;tetrakis(propan-2-ol)?
The InChIKey is BXSSQHCSSBJNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/4C3H8O.Ce/c4*1-3(2)4;/h4*3-4H,1-2H3;.
What are the key properties of cerium;tetrakis(propan-2-ol)?
cerium;tetrakis(propan-2-ol) has a molecular weight of 380.50 g/mol, XLogP of 1.55, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cerium;tetrakis(propan-2-ol) is sourced from PubChem (CID 87109563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).