butan-1-ol;ethanol;titanium;zirconium

C6H16O2TiZr — CID 173180305

IUPACbutan-1-ol;ethanol;titanium;zirconium
SMILESCCCCO.CCO.[Ti].[Zr]
InChIInChI=1S/C4H10O.C2H6O.Ti.Zr/c1-2-3-4-5;1-2-3;;/h5H,2-4H2,1H3;3H,2H2,1H3;;
InChIKeyOZWFSOJJWLGHCS-UHFFFAOYSA-N
MW259.28 g/mol
LogP0.77
Rot. Bonds2

About butan-1-ol;ethanol;titanium;zirconium

butan-1-ol;ethanol;titanium;zirconium (PubChem CID 173180305) has the molecular formula C6H16O2TiZr and a molecular weight of 259.28 g/mol. Its IUPAC name is butan-1-ol;ethanol;titanium;zirconium.

Molecular Properties

Compound Namebutan-1-ol;ethanol;titanium;zirconium
PubChem CID173180305
Molecular FormulaC6H16O2TiZr
Molecular Weight259.28 g/mol
Exact Mass257.97
IUPAC Namebutan-1-ol;ethanol;titanium;zirconium
SMILESCCCCO.CCO.[Ti].[Zr]
InChIInChI=1S/C4H10O.C2H6O.Ti.Zr/c1-2-3-4-5;1-2-3;;/h5H,2-4H2,1H3;3H,2H2,1H3;;
InChIKeyOZWFSOJJWLGHCS-UHFFFAOYSA-N
XLogP0.77
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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tris(butan-1-ol);ethanol;titanium;bromide;chloride
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CID 20523364
tetrakis(butan-1-ol);propane;titanium
CID 174520119
butan-1-ol;methanol;zirconium
CID 175401462
butan-1-ol
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(1,2,3,4-13C4)butan-1-ol
CID 71309697
barium(2+);butan-1-ol;hydride;titanium
CID 174712606
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CID 14228635
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CID 19774960

Frequently Asked Questions

What is the IUPAC name of butan-1-ol;ethanol;titanium;zirconium?
The IUPAC name of butan-1-ol;ethanol;titanium;zirconium (CID 173180305) is butan-1-ol;ethanol;titanium;zirconium.
What is the SMILES notation for butan-1-ol;ethanol;titanium;zirconium?
The canonical SMILES for butan-1-ol;ethanol;titanium;zirconium is CCCCO.CCO.[Ti].[Zr].
What is the InChIKey of butan-1-ol;ethanol;titanium;zirconium?
The InChIKey is OZWFSOJJWLGHCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C2H6O.Ti.Zr/c1-2-3-4-5;1-2-3;;/h5H,2-4H2,1H3;3H,2H2,1H3;;.
What are the key properties of butan-1-ol;ethanol;titanium;zirconium?
butan-1-ol;ethanol;titanium;zirconium has a molecular weight of 259.28 g/mol, XLogP of 0.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butan-1-ol;ethanol;titanium;zirconium is sourced from PubChem (CID 173180305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).