1-(2-propylsulfinylethylsulfinyl)propane

C8H18O2S2 — CID 6377263

IUPAC1-(2-propylsulfinylethylsulfinyl)propane
SMILESCCCS(=O)CCS(=O)CCC
InChIInChI=1S/C8H18O2S2/c1-3-5-11(9)7-8-12(10)6-4-2/h3-8H2,1-2H3
InChIKeyDMFQWXFUFQNRSE-UHFFFAOYSA-N
MW210.36 g/mol
LogP1.30
Rot. Bonds7

About 1-(2-propylsulfinylethylsulfinyl)propane

1-(2-propylsulfinylethylsulfinyl)propane (PubChem CID 6377263) has the molecular formula C8H18O2S2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-(2-propylsulfinylethylsulfinyl)propane.

Molecular Properties

Compound Name1-(2-propylsulfinylethylsulfinyl)propane
PubChem CID6377263
Molecular FormulaC8H18O2S2
Molecular Weight210.36 g/mol
Exact Mass210.07
IUPAC Name1-(2-propylsulfinylethylsulfinyl)propane
SMILESCCCS(=O)CCS(=O)CCC
InChIInChI=1S/C8H18O2S2/c1-3-5-11(9)7-8-12(10)6-4-2/h3-8H2,1-2H3
InChIKeyDMFQWXFUFQNRSE-UHFFFAOYSA-N
XLogP1.30
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-propylsulfinylethylsulfinyl)propane?
The IUPAC name of 1-(2-propylsulfinylethylsulfinyl)propane (CID 6377263) is 1-(2-propylsulfinylethylsulfinyl)propane.
What is the SMILES notation for 1-(2-propylsulfinylethylsulfinyl)propane?
The canonical SMILES for 1-(2-propylsulfinylethylsulfinyl)propane is CCCS(=O)CCS(=O)CCC.
What is the InChIKey of 1-(2-propylsulfinylethylsulfinyl)propane?
The InChIKey is DMFQWXFUFQNRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2S2/c1-3-5-11(9)7-8-12(10)6-4-2/h3-8H2,1-2H3.
What are the key properties of 1-(2-propylsulfinylethylsulfinyl)propane?
1-(2-propylsulfinylethylsulfinyl)propane has a molecular weight of 210.36 g/mol, XLogP of 1.30, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propylsulfinylethylsulfinyl)propane is sourced from PubChem (CID 6377263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).