tris(2-methylpropan-1-ol);oxovanadium

C12H30O4V — CID 29434

IUPACtris(2-methylpropan-1-ol);oxovanadium
SMILESCC(C)CO.CC(C)CO.CC(C)CO.O=[V]
InChIInChI=1S/3C4H10O.O.V/c3*1-4(2)3-5;;/h3*4-5H,3H2,1-2H3;;
InChIKeyCZMNFHBVFGQLCG-UHFFFAOYSA-N
MW289.31 g/mol
LogP1.78
Rot. Bonds3

About tris(2-methylpropan-1-ol);oxovanadium

tris(2-methylpropan-1-ol);oxovanadium (PubChem CID 29434) has the molecular formula C12H30O4V and a molecular weight of 289.31 g/mol. Its IUPAC name is tris(2-methylpropan-1-ol);oxovanadium.

Molecular Properties

Compound Nametris(2-methylpropan-1-ol);oxovanadium
PubChem CID29434
Molecular FormulaC12H30O4V
Molecular Weight289.31 g/mol
Exact Mass289.16
IUPAC Nametris(2-methylpropan-1-ol);oxovanadium
SMILESCC(C)CO.CC(C)CO.CC(C)CO.O=[V]
InChIInChI=1S/3C4H10O.O.V/c3*1-4(2)3-5;;/h3*4-5H,3H2,1-2H3;;
InChIKeyCZMNFHBVFGQLCG-UHFFFAOYSA-N
XLogP1.78
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 51.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of tris(2-methylpropan-1-ol);oxovanadium?
The IUPAC name of tris(2-methylpropan-1-ol);oxovanadium (CID 29434) is tris(2-methylpropan-1-ol);oxovanadium.
What is the SMILES notation for tris(2-methylpropan-1-ol);oxovanadium?
The canonical SMILES for tris(2-methylpropan-1-ol);oxovanadium is CC(C)CO.CC(C)CO.CC(C)CO.O=[V].
What is the InChIKey of tris(2-methylpropan-1-ol);oxovanadium?
The InChIKey is CZMNFHBVFGQLCG-UHFFFAOYSA-N. The full InChI is InChI=1S/3C4H10O.O.V/c3*1-4(2)3-5;;/h3*4-5H,3H2,1-2H3;;.
What are the key properties of tris(2-methylpropan-1-ol);oxovanadium?
tris(2-methylpropan-1-ol);oxovanadium has a molecular weight of 289.31 g/mol, XLogP of 1.78, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-methylpropan-1-ol);oxovanadium is sourced from PubChem (CID 29434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).