pentakis(butan-1-ol);vanadium

C20H50O5V — CID 14228635

IUPACpentakis(butan-1-ol);vanadium
SMILESCCCCO.CCCCO.CCCCO.CCCCO.CCCCO.[V]
InChIInChI=1S/5C4H10O.V/c5*1-2-3-4-5;/h5*5H,2-4H2,1H3;
InChIKeyORSLJWWCPUZDPT-UHFFFAOYSA-N
MW421.56 g/mol
LogP3.89
Rot. Bonds10

About pentakis(butan-1-ol);vanadium

pentakis(butan-1-ol);vanadium (PubChem CID 14228635) has the molecular formula C20H50O5V and a molecular weight of 421.56 g/mol. Its IUPAC name is pentakis(butan-1-ol);vanadium.

Molecular Properties

Compound Namepentakis(butan-1-ol);vanadium
PubChem CID14228635
Molecular FormulaC20H50O5V
Molecular Weight421.56 g/mol
Exact Mass421.31
IUPAC Namepentakis(butan-1-ol);vanadium
SMILESCCCCO.CCCCO.CCCCO.CCCCO.CCCCO.[V]
InChIInChI=1S/5C4H10O.V/c5*1-2-3-4-5;/h5*5H,2-4H2,1H3;
InChIKeyORSLJWWCPUZDPT-UHFFFAOYSA-N
XLogP3.89
TPSA101.15 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.56
LogP ≤ 53.89
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of pentakis(butan-1-ol);vanadium?
The IUPAC name of pentakis(butan-1-ol);vanadium (CID 14228635) is pentakis(butan-1-ol);vanadium.
What is the SMILES notation for pentakis(butan-1-ol);vanadium?
The canonical SMILES for pentakis(butan-1-ol);vanadium is CCCCO.CCCCO.CCCCO.CCCCO.CCCCO.[V].
What is the InChIKey of pentakis(butan-1-ol);vanadium?
The InChIKey is ORSLJWWCPUZDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/5C4H10O.V/c5*1-2-3-4-5;/h5*5H,2-4H2,1H3;.
What are the key properties of pentakis(butan-1-ol);vanadium?
pentakis(butan-1-ol);vanadium has a molecular weight of 421.56 g/mol, XLogP of 3.89, 10 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(butan-1-ol);vanadium is sourced from PubChem (CID 14228635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).