stiboric acid;sulfane

H9O4S3Sb — CID 172787968

IUPACstiboric acid;sulfane
SMILESO=[Sb](O)(O)O.S.S.S
InChIInChI=1S/3H2O.O.3H2S.Sb/h3*1H2;;3*1H2;/q;;;;;;;+3/p-3
InChIKeyPDWHWKSSJFTDCB-UHFFFAOYSA-K
MW291.03 g/mol
LogP-1.83
Rot. Bonds

About stiboric acid;sulfane

stiboric acid;sulfane (PubChem CID 172787968) has the molecular formula H9O4S3Sb and a molecular weight of 291.03 g/mol. Its IUPAC name is stiboric acid;sulfane.

Molecular Properties

Compound Namestiboric acid;sulfane
PubChem CID172787968
Molecular FormulaH9O4S3Sb
Molecular Weight291.03 g/mol
Exact Mass289.87
IUPAC Namestiboric acid;sulfane
SMILESO=[Sb](O)(O)O.S.S.S
InChIInChI=1S/3H2O.O.3H2S.Sb/h3*1H2;;3*1H2;/q;;;;;;;+3/p-3
InChIKeyPDWHWKSSJFTDCB-UHFFFAOYSA-K
XLogP-1.83
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.03
LogP ≤ 5-1.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of stiboric acid;sulfane?
The IUPAC name of stiboric acid;sulfane (CID 172787968) is stiboric acid;sulfane.
What is the SMILES notation for stiboric acid;sulfane?
The canonical SMILES for stiboric acid;sulfane is O=[Sb](O)(O)O.S.S.S.
What is the InChIKey of stiboric acid;sulfane?
The InChIKey is PDWHWKSSJFTDCB-UHFFFAOYSA-K. The full InChI is InChI=1S/3H2O.O.3H2S.Sb/h3*1H2;;3*1H2;/q;;;;;;;+3/p-3.
What are the key properties of stiboric acid;sulfane?
stiboric acid;sulfane has a molecular weight of 291.03 g/mol, XLogP of -1.83, 0 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for stiboric acid;sulfane is sourced from PubChem (CID 172787968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).