tetrakis(butan-1-ol);cerium

C16H40CeO4 — CID 87109841

IUPACtetrakis(butan-1-ol);cerium
SMILESCCCCO.CCCCO.CCCCO.CCCCO.[Ce]
InChIInChI=1S/4C4H10O.Ce/c4*1-2-3-4-5;/h4*5H,2-4H2,1H3;
InChIKeyOQGNIYMNBUPWBL-UHFFFAOYSA-N
MW436.61 g/mol
LogP3.12
Rot. Bonds8

About tetrakis(butan-1-ol);cerium

tetrakis(butan-1-ol);cerium (PubChem CID 87109841) has the molecular formula C16H40CeO4 and a molecular weight of 436.61 g/mol. Its IUPAC name is tetrakis(butan-1-ol);cerium.

Molecular Properties

Compound Nametetrakis(butan-1-ol);cerium
PubChem CID87109841
Molecular FormulaC16H40CeO4
Molecular Weight436.61 g/mol
Exact Mass436.20
IUPAC Nametetrakis(butan-1-ol);cerium
SMILESCCCCO.CCCCO.CCCCO.CCCCO.[Ce]
InChIInChI=1S/4C4H10O.Ce/c4*1-2-3-4-5;/h4*5H,2-4H2,1H3;
InChIKeyOQGNIYMNBUPWBL-UHFFFAOYSA-N
XLogP3.12
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.61
LogP ≤ 53.12
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze tetrakis(butan-1-ol);cerium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

butan-1-ol
CID 20532113
(1,2,3,4-13C4)butan-1-ol
CID 71309697
sodium butan-1-ol
CID 19366054
butan-1-ol;nickel
CID 22477011
butane;butan-1-ol
CID 19774960
tris(butan-1-ol);zirconium
CID 25200102
butan-1-ol;cadmium
CID 154199105
butan-1-ol;methanol
CID 23065762
butan-1-ol;plumbane
CID 173408910
pentakis(butan-1-ol);vanadium
CID 14228635
tris(butan-1-ol);titanium;bromide
CID 20523364
tetrakis(butan-1-ol);propane;titanium
CID 174520119

Frequently Asked Questions

What is the IUPAC name of tetrakis(butan-1-ol);cerium?
The IUPAC name of tetrakis(butan-1-ol);cerium (CID 87109841) is tetrakis(butan-1-ol);cerium.
What is the SMILES notation for tetrakis(butan-1-ol);cerium?
The canonical SMILES for tetrakis(butan-1-ol);cerium is CCCCO.CCCCO.CCCCO.CCCCO.[Ce].
What is the InChIKey of tetrakis(butan-1-ol);cerium?
The InChIKey is OQGNIYMNBUPWBL-UHFFFAOYSA-N. The full InChI is InChI=1S/4C4H10O.Ce/c4*1-2-3-4-5;/h4*5H,2-4H2,1H3;.
What are the key properties of tetrakis(butan-1-ol);cerium?
tetrakis(butan-1-ol);cerium has a molecular weight of 436.61 g/mol, XLogP of 3.12, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(butan-1-ol);cerium is sourced from PubChem (CID 87109841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).