2-hydroxyacetonitrile;yttrium

C2H2NOY- — CID 58851179

IUPAC2-hydroxyacetonitrile;yttrium
SMILESN#C[CH-]O.[Y]
InChIInChI=1S/C2H2NO.Y/c3-1-2-4;/h2,4H;/q-1;
InChIKeyQHSCEUQMRUXNIY-UHFFFAOYSA-N
MW144.95 g/mol
LogP0.04
Rot. Bonds

About 2-hydroxyacetonitrile;yttrium

2-hydroxyacetonitrile;yttrium (PubChem CID 58851179) has the molecular formula C2H2NOY- and a molecular weight of 144.95 g/mol. Its IUPAC name is 2-hydroxyacetonitrile;yttrium.

Molecular Properties

Compound Name2-hydroxyacetonitrile;yttrium
PubChem CID58851179
Molecular FormulaC2H2NOY-
Molecular Weight144.95 g/mol
Exact Mass144.92
IUPAC Name2-hydroxyacetonitrile;yttrium
SMILESN#C[CH-]O.[Y]
InChIInChI=1S/C2H2NO.Y/c3-1-2-4;/h2,4H;/q-1;
InChIKeyQHSCEUQMRUXNIY-UHFFFAOYSA-N
XLogP0.04
TPSA44.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.95
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyacetonitrile;yttrium?
The IUPAC name of 2-hydroxyacetonitrile;yttrium (CID 58851179) is 2-hydroxyacetonitrile;yttrium.
What is the SMILES notation for 2-hydroxyacetonitrile;yttrium?
The canonical SMILES for 2-hydroxyacetonitrile;yttrium is N#C[CH-]O.[Y].
What is the InChIKey of 2-hydroxyacetonitrile;yttrium?
The InChIKey is QHSCEUQMRUXNIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2NO.Y/c3-1-2-4;/h2,4H;/q-1;.
What are the key properties of 2-hydroxyacetonitrile;yttrium?
2-hydroxyacetonitrile;yttrium has a molecular weight of 144.95 g/mol, XLogP of 0.04, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyacetonitrile;yttrium is sourced from PubChem (CID 58851179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).