ethane;yttrium;nitrite

C2H5NO2Y-2 — CID 21028274

IUPACethane;yttrium;nitrite
SMILESO=N[O-].[CH2-]C.[Y]
InChIInChI=1S/C2H5.HNO2.Y/c1-2;2-1-3;/h1H2,2H3;(H,2,3);/q-1;;/p-1
InChIKeyBONPHPLZGLDAMD-UHFFFAOYSA-M
MW163.97 g/mol
LogP1.09
Rot. Bonds

About ethane;yttrium;nitrite

ethane;yttrium;nitrite (PubChem CID 21028274) has the molecular formula C2H5NO2Y-2 and a molecular weight of 163.97 g/mol. Its IUPAC name is ethane;yttrium;nitrite.

Molecular Properties

Compound Nameethane;yttrium;nitrite
PubChem CID21028274
Molecular FormulaC2H5NO2Y-2
Molecular Weight163.97 g/mol
Exact Mass163.94
IUPAC Nameethane;yttrium;nitrite
SMILESO=N[O-].[CH2-]C.[Y]
InChIInChI=1S/C2H5.HNO2.Y/c1-2;2-1-3;/h1H2,2H3;(H,2,3);/q-1;;/p-1
InChIKeyBONPHPLZGLDAMD-UHFFFAOYSA-M
XLogP1.09
TPSA52.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.97
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethane;yttrium;nitrite?
The IUPAC name of ethane;yttrium;nitrite (CID 21028274) is ethane;yttrium;nitrite.
What is the SMILES notation for ethane;yttrium;nitrite?
The canonical SMILES for ethane;yttrium;nitrite is O=N[O-].[CH2-]C.[Y].
What is the InChIKey of ethane;yttrium;nitrite?
The InChIKey is BONPHPLZGLDAMD-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H5.HNO2.Y/c1-2;2-1-3;/h1H2,2H3;(H,2,3);/q-1;;/p-1.
What are the key properties of ethane;yttrium;nitrite?
ethane;yttrium;nitrite has a molecular weight of 163.97 g/mol, XLogP of 1.09, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;yttrium;nitrite is sourced from PubChem (CID 21028274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).