2-(2-hydroxyethenyldisulfanyl)ethenol

C4H6O2S2 — CID 139910779

IUPAC2-(2-hydroxyethenyldisulfanyl)ethenol
SMILESOC=CSSC=CO
InChIInChI=1S/C4H6O2S2/c5-1-3-7-8-4-2-6/h1-6H
InChIKeyZWKSGIUWQGHPLR-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.43
Rot. Bonds3

About 2-(2-hydroxyethenyldisulfanyl)ethenol

2-(2-hydroxyethenyldisulfanyl)ethenol (PubChem CID 139910779) has the molecular formula C4H6O2S2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 2-(2-hydroxyethenyldisulfanyl)ethenol.

Molecular Properties

Compound Name2-(2-hydroxyethenyldisulfanyl)ethenol
PubChem CID139910779
Molecular FormulaC4H6O2S2
Molecular Weight150.22 g/mol
Exact Mass149.98
IUPAC Name2-(2-hydroxyethenyldisulfanyl)ethenol
SMILESOC=CSSC=CO
InChIInChI=1S/C4H6O2S2/c5-1-3-7-8-4-2-6/h1-6H
InChIKeyZWKSGIUWQGHPLR-UHFFFAOYSA-N
XLogP2.43
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethenyldisulfanyl)ethenol?
The IUPAC name of 2-(2-hydroxyethenyldisulfanyl)ethenol (CID 139910779) is 2-(2-hydroxyethenyldisulfanyl)ethenol.
What is the SMILES notation for 2-(2-hydroxyethenyldisulfanyl)ethenol?
The canonical SMILES for 2-(2-hydroxyethenyldisulfanyl)ethenol is OC=CSSC=CO.
What is the InChIKey of 2-(2-hydroxyethenyldisulfanyl)ethenol?
The InChIKey is ZWKSGIUWQGHPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O2S2/c5-1-3-7-8-4-2-6/h1-6H.
What are the key properties of 2-(2-hydroxyethenyldisulfanyl)ethenol?
2-(2-hydroxyethenyldisulfanyl)ethenol has a molecular weight of 150.22 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethenyldisulfanyl)ethenol is sourced from PubChem (CID 139910779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).