disulfanyloxyethane

C2H6OS2 — CID 89178705

IUPACdisulfanyloxyethane
SMILESCCOSS
InChIInChI=1S/C2H6OS2/c1-2-3-5-4/h4H,2H2,1H3
InChIKeyLYWRUWUEUJPECU-UHFFFAOYSA-N
MW110.20 g/mol
LogP1.52
Rot. Bonds2

About disulfanyloxyethane

disulfanyloxyethane (PubChem CID 89178705) has the molecular formula C2H6OS2 and a molecular weight of 110.20 g/mol. Its IUPAC name is disulfanyloxyethane.

Molecular Properties

Compound Namedisulfanyloxyethane
PubChem CID89178705
Molecular FormulaC2H6OS2
Molecular Weight110.20 g/mol
Exact Mass109.99
IUPAC Namedisulfanyloxyethane
SMILESCCOSS
InChIInChI=1S/C2H6OS2/c1-2-3-5-4/h4H,2H2,1H3
InChIKeyLYWRUWUEUJPECU-UHFFFAOYSA-N
XLogP1.52
TPSA9.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of disulfanyloxyethane?
The IUPAC name of disulfanyloxyethane (CID 89178705) is disulfanyloxyethane.
What is the SMILES notation for disulfanyloxyethane?
The canonical SMILES for disulfanyloxyethane is CCOSS.
What is the InChIKey of disulfanyloxyethane?
The InChIKey is LYWRUWUEUJPECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6OS2/c1-2-3-5-4/h4H,2H2,1H3.
What are the key properties of disulfanyloxyethane?
disulfanyloxyethane has a molecular weight of 110.20 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for disulfanyloxyethane is sourced from PubChem (CID 89178705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).