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

C12H30LaO3 — CID 140708551

IUPAClanthanum;tris(2-methylpropan-1-ol)
SMILESCC(C)CO.CC(C)CO.CC(C)CO.[La]
InChIInChI=1S/3C4H10O.La/c3*1-4(2)3-5;/h3*4-5H,3H2,1-2H3;
InChIKeyWTJWIZOKISPVKU-UHFFFAOYSA-N
MW361.28 g/mol
LogP1.90
Rot. Bonds3

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

lanthanum;tris(2-methylpropan-1-ol) (PubChem CID 140708551) has the molecular formula C12H30LaO3 and a molecular weight of 361.28 g/mol. Its IUPAC name is lanthanum;tris(2-methylpropan-1-ol).

Molecular Properties

Compound Namelanthanum;tris(2-methylpropan-1-ol)
PubChem CID140708551
Molecular FormulaC12H30LaO3
Molecular Weight361.28 g/mol
Exact Mass361.13
IUPAC Namelanthanum;tris(2-methylpropan-1-ol)
SMILESCC(C)CO.CC(C)CO.CC(C)CO.[La]
InChIInChI=1S/3C4H10O.La/c3*1-4(2)3-5;/h3*4-5H,3H2,1-2H3;
InChIKeyWTJWIZOKISPVKU-UHFFFAOYSA-N
XLogP1.90
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.28
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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tris(2-methylpropan-1-ol);titanium
CID 87503095
2-methylpropan-1-ol;zirconium;hydrochloride
CID 174563411
sodium;2-methylpropan-1-ol;chloride
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CID 174321240
magnesium;hydride;2-methylpropan-1-ol;hydrochloride
CID 173490256
2,2-dimethylpropane;2-methylpropan-1-ol
CID 158369394
magnesium;hydride;2-methylpropan-1-ol;hydroiodide
CID 174198179
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CID 22625576

Frequently Asked Questions

What is the IUPAC name of lanthanum;tris(2-methylpropan-1-ol)?
The IUPAC name of lanthanum;tris(2-methylpropan-1-ol) (CID 140708551) is lanthanum;tris(2-methylpropan-1-ol).
What is the SMILES notation for lanthanum;tris(2-methylpropan-1-ol)?
The canonical SMILES for lanthanum;tris(2-methylpropan-1-ol) is CC(C)CO.CC(C)CO.CC(C)CO.[La].
What is the InChIKey of lanthanum;tris(2-methylpropan-1-ol)?
The InChIKey is WTJWIZOKISPVKU-UHFFFAOYSA-N. The full InChI is InChI=1S/3C4H10O.La/c3*1-4(2)3-5;/h3*4-5H,3H2,1-2H3;.
What are the key properties of lanthanum;tris(2-methylpropan-1-ol)?
lanthanum;tris(2-methylpropan-1-ol) has a molecular weight of 361.28 g/mol, XLogP of 1.90, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lanthanum;tris(2-methylpropan-1-ol) is sourced from PubChem (CID 140708551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).