CID 173490862

O4S3-2 — CID 173490862

IUPAC—
SMILESO=S([O-])SS(=O)[O-]
InChIInChI=1S/H2O4S3/c1-6(2)5-7(3)4/h(H,1,2)(H,3,4)/p-2
InChIKeyHIDMBODCXVSEKA-UHFFFAOYSA-L
MW160.20 g/mol
LogP-0.69
Rot. Bonds2

About CID 173490862

CID 173490862 (PubChem CID 173490862) has the molecular formula O4S3-2 and a molecular weight of 160.20 g/mol.

Molecular Properties

Compound NameCID 173490862
PubChem CID173490862
Molecular FormulaO4S3-2
Molecular Weight160.20 g/mol
Exact Mass159.90
IUPAC Name—
SMILESO=S([O-])SS(=O)[O-]
InChIInChI=1S/H2O4S3/c1-6(2)5-7(3)4/h(H,1,2)(H,3,4)/p-2
InChIKeyHIDMBODCXVSEKA-UHFFFAOYSA-L
XLogP-0.69
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.20
LogP ≤ 5-0.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 173490862?
The IUPAC name of CID 173490862 (CID 173490862) is not available.
What is the SMILES notation for CID 173490862?
The canonical SMILES for CID 173490862 is O=S([O-])SS(=O)[O-].
What is the InChIKey of CID 173490862?
The InChIKey is HIDMBODCXVSEKA-UHFFFAOYSA-L. The full InChI is InChI=1S/H2O4S3/c1-6(2)5-7(3)4/h(H,1,2)(H,3,4)/p-2.
What are the key properties of CID 173490862?
CID 173490862 has a molecular weight of 160.20 g/mol, XLogP of -0.69, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173490862 is sourced from PubChem (CID 173490862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).