trisulfanyloxyethane

C2H6OS3 — CID 89072934

IUPACtrisulfanyloxyethane
SMILESCCOSSS
InChIInChI=1S/C2H6OS3/c1-2-3-5-6-4/h4H,2H2,1H3
InChIKeyISQHLTSTFHINMO-UHFFFAOYSA-N
MW142.27 g/mol
LogP2.16
Rot. Bonds3

About trisulfanyloxyethane

trisulfanyloxyethane (PubChem CID 89072934) has the molecular formula C2H6OS3 and a molecular weight of 142.27 g/mol. Its IUPAC name is trisulfanyloxyethane.

Molecular Properties

Compound Nametrisulfanyloxyethane
PubChem CID89072934
Molecular FormulaC2H6OS3
Molecular Weight142.27 g/mol
Exact Mass141.96
IUPAC Nametrisulfanyloxyethane
SMILESCCOSSS
InChIInChI=1S/C2H6OS3/c1-2-3-5-6-4/h4H,2H2,1H3
InChIKeyISQHLTSTFHINMO-UHFFFAOYSA-N
XLogP2.16
TPSA9.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.27
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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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Related Compounds

Ethanol-sulphide
CID 19899959
Heptasulfanyloxyethane
CID 129305029
Sulfanyloxyethane;hydrochloride
CID 19906505
Iron;sulfidooxyethane
CID 87527745
Disulfanylperoxyethane
CID 88942785
Disulfanyloxyethane
CID 89178705
CID 89316010
CID 89316010
Ethoxy-iodo-sulfanylidene-lambda4-sulfane
CID 89321737
CID 89328770
CID 89328770
CID 89330908
CID 89330908
CID 89338306
CID 89338306
Ethoxy-oxido-sulfanylidene-lambda4-sulfane
CID 89346157

Frequently Asked Questions

What is the IUPAC name of trisulfanyloxyethane?
The IUPAC name of trisulfanyloxyethane (CID 89072934) is trisulfanyloxyethane.
What is the SMILES notation for trisulfanyloxyethane?
The canonical SMILES for trisulfanyloxyethane is CCOSSS.
What is the InChIKey of trisulfanyloxyethane?
The InChIKey is ISQHLTSTFHINMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6OS3/c1-2-3-5-6-4/h4H,2H2,1H3.
What are the key properties of trisulfanyloxyethane?
trisulfanyloxyethane has a molecular weight of 142.27 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trisulfanyloxyethane is sourced from PubChem (CID 89072934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).