copper;(ethyldisulfanyl)ethane

C4H10CuS2 — CID 159600030

IUPACcopper;(ethyldisulfanyl)ethane
SMILESCCSSCC.[Cu]
InChIInChI=1S/C4H10S2.Cu/c1-3-5-6-4-2;/h3-4H2,1-2H3;
InChIKeyMLIYEWFCXFMJIS-UHFFFAOYSA-N
MW185.80 g/mol
LogP2.41
Rot. Bonds3

About copper;(ethyldisulfanyl)ethane

copper;(ethyldisulfanyl)ethane (PubChem CID 159600030) has the molecular formula C4H10CuS2 and a molecular weight of 185.80 g/mol. Its IUPAC name is copper;(ethyldisulfanyl)ethane.

Molecular Properties

Compound Namecopper;(ethyldisulfanyl)ethane
PubChem CID159600030
Molecular FormulaC4H10CuS2
Molecular Weight185.80 g/mol
Exact Mass184.95
IUPAC Namecopper;(ethyldisulfanyl)ethane
SMILESCCSSCC.[Cu]
InChIInChI=1S/C4H10S2.Cu/c1-3-5-6-4-2;/h3-4H2,1-2H3;
InChIKeyMLIYEWFCXFMJIS-UHFFFAOYSA-N
XLogP2.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.80
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 copper;(ethyldisulfanyl)ethane?
The IUPAC name of copper;(ethyldisulfanyl)ethane (CID 159600030) is copper;(ethyldisulfanyl)ethane.
What is the SMILES notation for copper;(ethyldisulfanyl)ethane?
The canonical SMILES for copper;(ethyldisulfanyl)ethane is CCSSCC.[Cu].
What is the InChIKey of copper;(ethyldisulfanyl)ethane?
The InChIKey is MLIYEWFCXFMJIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10S2.Cu/c1-3-5-6-4-2;/h3-4H2,1-2H3;.
What are the key properties of copper;(ethyldisulfanyl)ethane?
copper;(ethyldisulfanyl)ethane has a molecular weight of 185.80 g/mol, XLogP of 2.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;(ethyldisulfanyl)ethane is sourced from PubChem (CID 159600030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).