5-hydroxy-2H-pyran-2-id-4-one;yttrium

C5H3O3Y- — CID 165116401

IUPAC5-hydroxy-2H-pyran-2-id-4-one;yttrium
SMILESO=c1c[c-]occ1O.[Y]
InChIInChI=1S/C5H3O3.Y/c6-4-1-2-8-3-5(4)7;/h1,3,7H;/q-1;
InChIKeyDRRKONIUVFJLJI-UHFFFAOYSA-N
MW199.98 g/mol
LogP0.14
Rot. Bonds

About 5-hydroxy-2H-pyran-2-id-4-one;yttrium

5-hydroxy-2H-pyran-2-id-4-one;yttrium (PubChem CID 165116401) has the molecular formula C5H3O3Y- and a molecular weight of 199.98 g/mol. Its IUPAC name is 5-hydroxy-2H-pyran-2-id-4-one;yttrium.

Molecular Properties

Compound Name5-hydroxy-2H-pyran-2-id-4-one;yttrium
PubChem CID165116401
Molecular FormulaC5H3O3Y-
Molecular Weight199.98 g/mol
Exact Mass199.91
IUPAC Name5-hydroxy-2H-pyran-2-id-4-one;yttrium
SMILESO=c1c[c-]occ1O.[Y]
InChIInChI=1S/C5H3O3.Y/c6-4-1-2-8-3-5(4)7;/h1,3,7H;/q-1;
InChIKeyDRRKONIUVFJLJI-UHFFFAOYSA-N
XLogP0.14
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.98
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-2H-pyran-2-id-4-one;yttrium?
The IUPAC name of 5-hydroxy-2H-pyran-2-id-4-one;yttrium (CID 165116401) is 5-hydroxy-2H-pyran-2-id-4-one;yttrium.
What is the SMILES notation for 5-hydroxy-2H-pyran-2-id-4-one;yttrium?
The canonical SMILES for 5-hydroxy-2H-pyran-2-id-4-one;yttrium is O=c1c[c-]occ1O.[Y].
What is the InChIKey of 5-hydroxy-2H-pyran-2-id-4-one;yttrium?
The InChIKey is DRRKONIUVFJLJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3O3.Y/c6-4-1-2-8-3-5(4)7;/h1,3,7H;/q-1;.
What are the key properties of 5-hydroxy-2H-pyran-2-id-4-one;yttrium?
5-hydroxy-2H-pyran-2-id-4-one;yttrium has a molecular weight of 199.98 g/mol, XLogP of 0.14, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-2H-pyran-2-id-4-one;yttrium is sourced from PubChem (CID 165116401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).