ethoxysulfinylsulfanylsulfinyloxyethane

C4H10O4S3 — CID 88801277

IUPACethoxysulfinylsulfanylsulfinyloxyethane
SMILESCCOS(=O)SS(=O)OCC
InChIInChI=1S/C4H10O4S3/c1-3-7-10(5)9-11(6)8-4-2/h3-4H2,1-2H3
InChIKeyHHNQLJWOBKKFDR-UHFFFAOYSA-N
MW218.32 g/mol
LogP0.95
Rot. Bonds6

About ethoxysulfinylsulfanylsulfinyloxyethane

ethoxysulfinylsulfanylsulfinyloxyethane (PubChem CID 88801277) has the molecular formula C4H10O4S3 and a molecular weight of 218.32 g/mol. Its IUPAC name is ethoxysulfinylsulfanylsulfinyloxyethane.

Molecular Properties

Compound Nameethoxysulfinylsulfanylsulfinyloxyethane
PubChem CID88801277
Molecular FormulaC4H10O4S3
Molecular Weight218.32 g/mol
Exact Mass217.97
IUPAC Nameethoxysulfinylsulfanylsulfinyloxyethane
SMILESCCOS(=O)SS(=O)OCC
InChIInChI=1S/C4H10O4S3/c1-3-7-10(5)9-11(6)8-4-2/h3-4H2,1-2H3
InChIKeyHHNQLJWOBKKFDR-UHFFFAOYSA-N
XLogP0.95
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze ethoxysulfinylsulfanylsulfinyloxyethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethoxysulfinylsulfanylsulfinyloxyethane?
The IUPAC name of ethoxysulfinylsulfanylsulfinyloxyethane (CID 88801277) is ethoxysulfinylsulfanylsulfinyloxyethane.
What is the SMILES notation for ethoxysulfinylsulfanylsulfinyloxyethane?
The canonical SMILES for ethoxysulfinylsulfanylsulfinyloxyethane is CCOS(=O)SS(=O)OCC.
What is the InChIKey of ethoxysulfinylsulfanylsulfinyloxyethane?
The InChIKey is HHNQLJWOBKKFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O4S3/c1-3-7-10(5)9-11(6)8-4-2/h3-4H2,1-2H3.
What are the key properties of ethoxysulfinylsulfanylsulfinyloxyethane?
ethoxysulfinylsulfanylsulfinyloxyethane has a molecular weight of 218.32 g/mol, XLogP of 0.95, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxysulfinylsulfanylsulfinyloxyethane is sourced from PubChem (CID 88801277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).