1,2,3,5-tetrathiane

C2H4S4 — CID 6428769

IUPAC1,2,3,5-tetrathiane
SMILESC1SCSSS1
InChIInChI=1S/C2H4S4/c1-3-2-5-6-4-1/h1-2H2
InChIKeySXOZCTIVHNLKAZ-UHFFFAOYSA-N
MW156.32 g/mol
LogP2.68
Rot. Bonds

About 1,2,3,5-tetrathiane

1,2,3,5-tetrathiane (PubChem CID 6428769) has the molecular formula C2H4S4 and a molecular weight of 156.32 g/mol. Its IUPAC name is 1,2,3,5-tetrathiane.

Molecular Properties

Compound Name1,2,3,5-tetrathiane
PubChem CID6428769
Molecular FormulaC2H4S4
Molecular Weight156.32 g/mol
Exact Mass155.92
IUPAC Name1,2,3,5-tetrathiane
SMILESC1SCSSS1
InChIInChI=1S/C2H4S4/c1-3-2-5-6-4-1/h1-2H2
InChIKeySXOZCTIVHNLKAZ-UHFFFAOYSA-N
XLogP2.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.32
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,5-tetrathiane?
The IUPAC name of 1,2,3,5-tetrathiane (CID 6428769) is 1,2,3,5-tetrathiane.
What is the SMILES notation for 1,2,3,5-tetrathiane?
The canonical SMILES for 1,2,3,5-tetrathiane is C1SCSSS1.
What is the InChIKey of 1,2,3,5-tetrathiane?
The InChIKey is SXOZCTIVHNLKAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4S4/c1-3-2-5-6-4-1/h1-2H2.
What are the key properties of 1,2,3,5-tetrathiane?
1,2,3,5-tetrathiane has a molecular weight of 156.32 g/mol, XLogP of 2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,5-tetrathiane is sourced from PubChem (CID 6428769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).