1,2-bis(ethylsulfinyl)ethane

C6H14O2S2 — CID 6377095

IUPAC1,2-bis(ethylsulfinyl)ethane
SMILESCCS(=O)CCS(=O)CC
InChIInChI=1S/C6H14O2S2/c1-3-9(7)5-6-10(8)4-2/h3-6H2,1-2H3
InChIKeyDJUBALJYCPBJNN-UHFFFAOYSA-N
MW182.31 g/mol
LogP0.52
Rot. Bonds5

About 1,2-bis(ethylsulfinyl)ethane

1,2-bis(ethylsulfinyl)ethane (PubChem CID 6377095) has the molecular formula C6H14O2S2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1,2-bis(ethylsulfinyl)ethane.

Molecular Properties

Compound Name1,2-bis(ethylsulfinyl)ethane
PubChem CID6377095
Molecular FormulaC6H14O2S2
Molecular Weight182.31 g/mol
Exact Mass182.04
IUPAC Name1,2-bis(ethylsulfinyl)ethane
SMILESCCS(=O)CCS(=O)CC
InChIInChI=1S/C6H14O2S2/c1-3-9(7)5-6-10(8)4-2/h3-6H2,1-2H3
InChIKeyDJUBALJYCPBJNN-UHFFFAOYSA-N
XLogP0.52
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 50.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Diethyl sulfoxide
CID 6263
Isopropyl sulfoxide
CID 16645
Ethyl sulfone
CID 69004
1,4-Dithiane 1,4-dioxide
CID 272078
1,2-Bis(ethylsulfonyl)ethane
CID 118582
Ethyl (ethylthio)methyl sulphoxide
CID 3015888
1,1'-Sulfonylbis(2-(methylsulfinyl)ethane)
CID 126251
Ethane, 1-(ethylsulfonyl)-2-(methylthio)-
CID 184429
2,4,6-Trimethyl-(1,3,5)trithiane 1,3,5-trioxide
CID 241688
1-Methylsulfinyl-2-(2-(methylthio)ethylsulfonyl)ethane
CID 126252
1,1'-Sulfonylbis(2-(methylthio)ethane)
CID 15089716
Methyl 2-propan-2-ylsulfinylethanedithioate
CID 100979294

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(ethylsulfinyl)ethane?
The IUPAC name of 1,2-bis(ethylsulfinyl)ethane (CID 6377095) is 1,2-bis(ethylsulfinyl)ethane.
What is the SMILES notation for 1,2-bis(ethylsulfinyl)ethane?
The canonical SMILES for 1,2-bis(ethylsulfinyl)ethane is CCS(=O)CCS(=O)CC.
What is the InChIKey of 1,2-bis(ethylsulfinyl)ethane?
The InChIKey is DJUBALJYCPBJNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2S2/c1-3-9(7)5-6-10(8)4-2/h3-6H2,1-2H3.
What are the key properties of 1,2-bis(ethylsulfinyl)ethane?
1,2-bis(ethylsulfinyl)ethane has a molecular weight of 182.31 g/mol, XLogP of 0.52, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(ethylsulfinyl)ethane is sourced from PubChem (CID 6377095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).