CID 173129997

HO3SYb- — CID 173129997

IUPAC—
SMILESO=[S-](=O)O.[Yb]
InChIInChI=1S/HO3S.Yb/c1-4(2)3;/h(H,1,2,3);/q-1;
InChIKeyNUTISQHFQBYXRH-UHFFFAOYSA-N
MW254.11 g/mol
LogP-0.23
Rot. Bonds

About CID 173129997

CID 173129997 (PubChem CID 173129997) has the molecular formula HO3SYb- and a molecular weight of 254.11 g/mol.

Molecular Properties

Compound NameCID 173129997
PubChem CID173129997
Molecular FormulaHO3SYb-
Molecular Weight254.11 g/mol
Exact Mass254.90
IUPAC Name—
SMILESO=[S-](=O)O.[Yb]
InChIInChI=1S/HO3S.Yb/c1-4(2)3;/h(H,1,2,3);/q-1;
InChIKeyNUTISQHFQBYXRH-UHFFFAOYSA-N
XLogP-0.23
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.11
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 173129997?
The IUPAC name of CID 173129997 (CID 173129997) is not available.
What is the SMILES notation for CID 173129997?
The canonical SMILES for CID 173129997 is O=[S-](=O)O.[Yb].
What is the InChIKey of CID 173129997?
The InChIKey is NUTISQHFQBYXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/HO3S.Yb/c1-4(2)3;/h(H,1,2,3);/q-1;.
What are the key properties of CID 173129997?
CID 173129997 has a molecular weight of 254.11 g/mol, XLogP of -0.23, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173129997 is sourced from PubChem (CID 173129997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).