5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide

C6H12O6S2 — CID 71337149

IUPAC5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide
SMILESCC1(C)OS(=O)(=O)OS(=O)(=O)C1(C)C
InChIInChI=1S/C6H12O6S2/c1-5(2)6(3,4)13(7,8)12-14(9,10)11-5/h1-4H3
InChIKeyQLNIFQGBYSHNSS-UHFFFAOYSA-N
MW244.29 g/mol
LogP0.17
Rot. Bonds

About 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide

5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide (PubChem CID 71337149) has the molecular formula C6H12O6S2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide.

Molecular Properties

Compound Name5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide
PubChem CID71337149
Molecular FormulaC6H12O6S2
Molecular Weight244.29 g/mol
Exact Mass244.01
IUPAC Name5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide
SMILESCC1(C)OS(=O)(=O)OS(=O)(=O)C1(C)C
InChIInChI=1S/C6H12O6S2/c1-5(2)6(3,4)13(7,8)12-14(9,10)11-5/h1-4H3
InChIKeyQLNIFQGBYSHNSS-UHFFFAOYSA-N
XLogP0.17
TPSA86.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 50.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide?
The IUPAC name of 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide (CID 71337149) is 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide.
What is the SMILES notation for 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide?
The canonical SMILES for 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide is CC1(C)OS(=O)(=O)OS(=O)(=O)C1(C)C.
What is the InChIKey of 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide?
The InChIKey is QLNIFQGBYSHNSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O6S2/c1-5(2)6(3,4)13(7,8)12-14(9,10)11-5/h1-4H3.
What are the key properties of 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide?
5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide has a molecular weight of 244.29 g/mol, XLogP of 0.17, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,6,6-tetramethyl-1,3,2,4-dioxadithiane 2,2,4,4-tetraoxide is sourced from PubChem (CID 71337149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).