bis(1-ethenylsulfonylethene);methanol

C9H16O5S2 — CID 19939004

IUPACbis(1-ethenylsulfonylethene);methanol
SMILESC=CS(=O)(=O)C=C.C=CS(=O)(=O)C=C.CO
InChIInChI=1S/2C4H6O2S.CH4O/c2*1-3-7(5,6)4-2;1-2/h2*3-4H,1-2H2;2H,1H3
InChIKeyFXVMNOGEZJSXFG-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.98
Rot. Bonds4

About bis(1-ethenylsulfonylethene);methanol

bis(1-ethenylsulfonylethene);methanol (PubChem CID 19939004) has the molecular formula C9H16O5S2 and a molecular weight of 268.36 g/mol. Its IUPAC name is bis(1-ethenylsulfonylethene);methanol.

Molecular Properties

Compound Namebis(1-ethenylsulfonylethene);methanol
PubChem CID19939004
Molecular FormulaC9H16O5S2
Molecular Weight268.36 g/mol
Exact Mass268.04
IUPAC Namebis(1-ethenylsulfonylethene);methanol
SMILESC=CS(=O)(=O)C=C.C=CS(=O)(=O)C=C.CO
InChIInChI=1S/2C4H6O2S.CH4O/c2*1-3-7(5,6)4-2;1-2/h2*3-4H,1-2H2;2H,1H3
InChIKeyFXVMNOGEZJSXFG-UHFFFAOYSA-N
XLogP0.98
TPSA88.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of bis(1-ethenylsulfonylethene);methanol?
The IUPAC name of bis(1-ethenylsulfonylethene);methanol (CID 19939004) is bis(1-ethenylsulfonylethene);methanol.
What is the SMILES notation for bis(1-ethenylsulfonylethene);methanol?
The canonical SMILES for bis(1-ethenylsulfonylethene);methanol is C=CS(=O)(=O)C=C.C=CS(=O)(=O)C=C.CO.
What is the InChIKey of bis(1-ethenylsulfonylethene);methanol?
The InChIKey is FXVMNOGEZJSXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H6O2S.CH4O/c2*1-3-7(5,6)4-2;1-2/h2*3-4H,1-2H2;2H,1H3.
What are the key properties of bis(1-ethenylsulfonylethene);methanol?
bis(1-ethenylsulfonylethene);methanol has a molecular weight of 268.36 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-ethenylsulfonylethene);methanol is sourced from PubChem (CID 19939004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).