CID 174259185

HCdO3SSe- — CID 174259185

IUPAC—
SMILESO=[S-](=O)O.[Se]=[Cd]
InChIInChI=1S/Cd.HO3S.Se/c;1-4(2)3;/h;(H,1,2,3);/q;-1;
InChIKeyOTDUJCHTANPYBM-UHFFFAOYSA-N
MW272.44 g/mol
LogP-0.61
Rot. Bonds

About CID 174259185

CID 174259185 (PubChem CID 174259185) has the molecular formula HCdO3SSe- and a molecular weight of 272.44 g/mol.

Molecular Properties

Compound NameCID 174259185
PubChem CID174259185
Molecular FormulaHCdO3SSe-
Molecular Weight272.44 g/mol
Exact Mass274.79
IUPAC Name—
SMILESO=[S-](=O)O.[Se]=[Cd]
InChIInChI=1S/Cd.HO3S.Se/c;1-4(2)3;/h;(H,1,2,3);/q;-1;
InChIKeyOTDUJCHTANPYBM-UHFFFAOYSA-N
XLogP-0.61
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'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 174259185?
The IUPAC name of CID 174259185 (CID 174259185) is not available.
What is the SMILES notation for CID 174259185?
The canonical SMILES for CID 174259185 is O=[S-](=O)O.[Se]=[Cd].
What is the InChIKey of CID 174259185?
The InChIKey is OTDUJCHTANPYBM-UHFFFAOYSA-N. The full InChI is InChI=1S/Cd.HO3S.Se/c;1-4(2)3;/h;(H,1,2,3);/q;-1;.
What are the key properties of CID 174259185?
CID 174259185 has a molecular weight of 272.44 g/mol, XLogP of -0.61, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174259185 is sourced from PubChem (CID 174259185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).