pentakis(butan-2-ol);molybdenum

C20H50MoO5 — CID 152613437

IUPACpentakis(butan-2-ol);molybdenum
SMILESCCC(C)O.CCC(C)O.CCC(C)O.CCC(C)O.CCC(C)O.[Mo]
InChIInChI=1S/5C4H10O.Mo/c5*1-3-4(2)5;/h5*4-5H,3H2,1-2H3;
InChIKeyDREYYKZIBGXJGG-UHFFFAOYSA-N
MW466.56 g/mol
LogP3.88
Rot. Bonds5

About pentakis(butan-2-ol);molybdenum

pentakis(butan-2-ol);molybdenum (PubChem CID 152613437) has the molecular formula C20H50MoO5 and a molecular weight of 466.56 g/mol. Its IUPAC name is pentakis(butan-2-ol);molybdenum.

Molecular Properties

Compound Namepentakis(butan-2-ol);molybdenum
PubChem CID152613437
Molecular FormulaC20H50MoO5
Molecular Weight466.56 g/mol
Exact Mass468.27
IUPAC Namepentakis(butan-2-ol);molybdenum
SMILESCCC(C)O.CCC(C)O.CCC(C)O.CCC(C)O.CCC(C)O.[Mo]
InChIInChI=1S/5C4H10O.Mo/c5*1-3-4(2)5;/h5*4-5H,3H2,1-2H3;
InChIKeyDREYYKZIBGXJGG-UHFFFAOYSA-N
XLogP3.88
TPSA101.15 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.56
LogP ≤ 53.88
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of pentakis(butan-2-ol);molybdenum?
The IUPAC name of pentakis(butan-2-ol);molybdenum (CID 152613437) is pentakis(butan-2-ol);molybdenum.
What is the SMILES notation for pentakis(butan-2-ol);molybdenum?
The canonical SMILES for pentakis(butan-2-ol);molybdenum is CCC(C)O.CCC(C)O.CCC(C)O.CCC(C)O.CCC(C)O.[Mo].
What is the InChIKey of pentakis(butan-2-ol);molybdenum?
The InChIKey is DREYYKZIBGXJGG-UHFFFAOYSA-N. The full InChI is InChI=1S/5C4H10O.Mo/c5*1-3-4(2)5;/h5*4-5H,3H2,1-2H3;.
What are the key properties of pentakis(butan-2-ol);molybdenum?
pentakis(butan-2-ol);molybdenum has a molecular weight of 466.56 g/mol, XLogP of 3.88, 5 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(butan-2-ol);molybdenum is sourced from PubChem (CID 152613437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).