disulfanyl-hydroxy-oxophosphanium

H2O2PS2+ — CID 173088429

IUPACdisulfanyl-hydroxy-oxophosphanium
SMILESO=[P+](O)SS
InChIInChI=1S/HO2PS2/c1-3(2)5-4/h(H-,1,2,4)/p+1
InChIKeyYCDVRWKVTFCBRM-UHFFFAOYSA-O
MW129.12 g/mol
LogP1.21
Rot. Bonds1

About disulfanyl-hydroxy-oxophosphanium

disulfanyl-hydroxy-oxophosphanium (PubChem CID 173088429) has the molecular formula H2O2PS2+ and a molecular weight of 129.12 g/mol. Its IUPAC name is disulfanyl-hydroxy-oxophosphanium.

Molecular Properties

Compound Namedisulfanyl-hydroxy-oxophosphanium
PubChem CID173088429
Molecular FormulaH2O2PS2+
Molecular Weight129.12 g/mol
Exact Mass128.92
IUPAC Namedisulfanyl-hydroxy-oxophosphanium
SMILESO=[P+](O)SS
InChIInChI=1S/HO2PS2/c1-3(2)5-4/h(H-,1,2,4)/p+1
InChIKeyYCDVRWKVTFCBRM-UHFFFAOYSA-O
XLogP1.21
TPSA37.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.12
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of disulfanyl-hydroxy-oxophosphanium?
The IUPAC name of disulfanyl-hydroxy-oxophosphanium (CID 173088429) is disulfanyl-hydroxy-oxophosphanium.
What is the SMILES notation for disulfanyl-hydroxy-oxophosphanium?
The canonical SMILES for disulfanyl-hydroxy-oxophosphanium is O=[P+](O)SS.
What is the InChIKey of disulfanyl-hydroxy-oxophosphanium?
The InChIKey is YCDVRWKVTFCBRM-UHFFFAOYSA-O. The full InChI is InChI=1S/HO2PS2/c1-3(2)5-4/h(H-,1,2,4)/p+1.
What are the key properties of disulfanyl-hydroxy-oxophosphanium?
disulfanyl-hydroxy-oxophosphanium has a molecular weight of 129.12 g/mol, XLogP of 1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for disulfanyl-hydroxy-oxophosphanium is sourced from PubChem (CID 173088429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).