pentan-1-ol;yttrium

C5H12OY — CID 154312100

IUPACpentan-1-ol;yttrium
SMILESCCCCCO.[Y]
InChIInChI=1S/C5H12O.Y/c1-2-3-4-5-6;/h6H,2-5H2,1H3;
InChIKeyJLJMGDKYCQOKMZ-UHFFFAOYSA-N
MW177.06 g/mol
LogP1.17
Rot. Bonds3

About pentan-1-ol;yttrium

pentan-1-ol;yttrium (PubChem CID 154312100) has the molecular formula C5H12OY and a molecular weight of 177.06 g/mol. Its IUPAC name is pentan-1-ol;yttrium.

Molecular Properties

Compound Namepentan-1-ol;yttrium
PubChem CID154312100
Molecular FormulaC5H12OY
Molecular Weight177.06 g/mol
Exact Mass176.99
IUPAC Namepentan-1-ol;yttrium
SMILESCCCCCO.[Y]
InChIInChI=1S/C5H12O.Y/c1-2-3-4-5-6;/h6H,2-5H2,1H3;
InChIKeyJLJMGDKYCQOKMZ-UHFFFAOYSA-N
XLogP1.17
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.06
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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CID 159582596
nonadecakis(heptane);nonan-1-ol
CID 173279398
heptan-1-ol;nonan-1-ol
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heptatriacontan-1-ol
CID 537071
undecan-1-ol
CID 122455065
gold;pentan-1-ol
CID 152701196
nickel;pentan-1-ol
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azane;tris(pentan-1-ol)
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Frequently Asked Questions

What is the IUPAC name of pentan-1-ol;yttrium?
The IUPAC name of pentan-1-ol;yttrium (CID 154312100) is pentan-1-ol;yttrium.
What is the SMILES notation for pentan-1-ol;yttrium?
The canonical SMILES for pentan-1-ol;yttrium is CCCCCO.[Y].
What is the InChIKey of pentan-1-ol;yttrium?
The InChIKey is JLJMGDKYCQOKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O.Y/c1-2-3-4-5-6;/h6H,2-5H2,1H3;.
What are the key properties of pentan-1-ol;yttrium?
pentan-1-ol;yttrium has a molecular weight of 177.06 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pentan-1-ol;yttrium is sourced from PubChem (CID 154312100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).