bis(furan-2-yl) sulfate

C8H6O6S — CID 70505837

IUPACbis(furan-2-yl) sulfate
SMILESO=S(=O)(Oc1ccco1)Oc1ccco1
InChIInChI=1S/C8H6O6S/c9-15(10,13-7-3-1-5-11-7)14-8-4-2-6-12-8/h1-6H
InChIKeyYVIGUHIGBQXNPU-UHFFFAOYSA-N
MW230.20 g/mol
LogP1.58
Rot. Bonds4

About bis(furan-2-yl) sulfate

bis(furan-2-yl) sulfate (PubChem CID 70505837) has the molecular formula C8H6O6S and a molecular weight of 230.20 g/mol. Its IUPAC name is bis(furan-2-yl) sulfate.

Molecular Properties

Compound Namebis(furan-2-yl) sulfate
PubChem CID70505837
Molecular FormulaC8H6O6S
Molecular Weight230.20 g/mol
Exact Mass229.99
IUPAC Namebis(furan-2-yl) sulfate
SMILESO=S(=O)(Oc1ccco1)Oc1ccco1
InChIInChI=1S/C8H6O6S/c9-15(10,13-7-3-1-5-11-7)14-8-4-2-6-12-8/h1-6H
InChIKeyYVIGUHIGBQXNPU-UHFFFAOYSA-N
XLogP1.58
TPSA78.88 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.20
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze bis(furan-2-yl) sulfate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(furan-2-yl) sulfate?
The IUPAC name of bis(furan-2-yl) sulfate (CID 70505837) is bis(furan-2-yl) sulfate.
What is the SMILES notation for bis(furan-2-yl) sulfate?
The canonical SMILES for bis(furan-2-yl) sulfate is O=S(=O)(Oc1ccco1)Oc1ccco1.
What is the InChIKey of bis(furan-2-yl) sulfate?
The InChIKey is YVIGUHIGBQXNPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O6S/c9-15(10,13-7-3-1-5-11-7)14-8-4-2-6-12-8/h1-6H.
What are the key properties of bis(furan-2-yl) sulfate?
bis(furan-2-yl) sulfate has a molecular weight of 230.20 g/mol, XLogP of 1.58, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(furan-2-yl) sulfate is sourced from PubChem (CID 70505837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).