ethene;sulfane

C8H20S2 — CID 173042161

IUPACethene;sulfane
SMILESC=C.C=C.C=C.C=C.S.S
InChIInChI=1S/4C2H4.2H2S/c4*1-2;;/h4*1-2H2;2*1H2
InChIKeyVTLZTWJGNYAULN-UHFFFAOYSA-N
MW180.38 g/mol
LogP3.43
Rot. Bonds

About ethene;sulfane

ethene;sulfane (PubChem CID 173042161) has the molecular formula C8H20S2 and a molecular weight of 180.38 g/mol. Its IUPAC name is ethene;sulfane.

Molecular Properties

Compound Nameethene;sulfane
PubChem CID173042161
Molecular FormulaC8H20S2
Molecular Weight180.38 g/mol
Exact Mass180.10
IUPAC Nameethene;sulfane
SMILESC=C.C=C.C=C.C=C.S.S
InChIInChI=1S/4C2H4.2H2S/c4*1-2;;/h4*1-2H2;2*1H2
InChIKeyVTLZTWJGNYAULN-UHFFFAOYSA-N
XLogP3.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.38
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethene;sulfane?
The IUPAC name of ethene;sulfane (CID 173042161) is ethene;sulfane.
What is the SMILES notation for ethene;sulfane?
The canonical SMILES for ethene;sulfane is C=C.C=C.C=C.C=C.S.S.
What is the InChIKey of ethene;sulfane?
The InChIKey is VTLZTWJGNYAULN-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H4.2H2S/c4*1-2;;/h4*1-2H2;2*1H2.
What are the key properties of ethene;sulfane?
ethene;sulfane has a molecular weight of 180.38 g/mol, XLogP of 3.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;sulfane is sourced from PubChem (CID 173042161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).