5-methylsulfanylfuro[2,3-b]furan

C7H6O2S — CID 123294271

IUPAC5-methylsulfanylfuro[2,3-b]furan
SMILESCSc1cc2ccoc2o1
InChIInChI=1S/C7H6O2S/c1-10-6-4-5-2-3-8-7(5)9-6/h2-4H,1H3
InChIKeyMNVNBBJLJRDOCE-UHFFFAOYSA-N
MW154.19 g/mol
LogP2.75
Rot. Bonds1

About 5-methylsulfanylfuro[2,3-b]furan

5-methylsulfanylfuro[2,3-b]furan (PubChem CID 123294271) has the molecular formula C7H6O2S and a molecular weight of 154.19 g/mol. Its IUPAC name is 5-methylsulfanylfuro[2,3-b]furan.

Molecular Properties

Compound Name5-methylsulfanylfuro[2,3-b]furan
PubChem CID123294271
Molecular FormulaC7H6O2S
Molecular Weight154.19 g/mol
Exact Mass154.01
IUPAC Name5-methylsulfanylfuro[2,3-b]furan
SMILESCSc1cc2ccoc2o1
InChIInChI=1S/C7H6O2S/c1-10-6-4-5-2-3-8-7(5)9-6/h2-4H,1H3
InChIKeyMNVNBBJLJRDOCE-UHFFFAOYSA-N
XLogP2.75
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methylsulfanylfuro[2,3-b]furan?
The IUPAC name of 5-methylsulfanylfuro[2,3-b]furan (CID 123294271) is 5-methylsulfanylfuro[2,3-b]furan.
What is the SMILES notation for 5-methylsulfanylfuro[2,3-b]furan?
The canonical SMILES for 5-methylsulfanylfuro[2,3-b]furan is CSc1cc2ccoc2o1.
What is the InChIKey of 5-methylsulfanylfuro[2,3-b]furan?
The InChIKey is MNVNBBJLJRDOCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O2S/c1-10-6-4-5-2-3-8-7(5)9-6/h2-4H,1H3.
What are the key properties of 5-methylsulfanylfuro[2,3-b]furan?
5-methylsulfanylfuro[2,3-b]furan has a molecular weight of 154.19 g/mol, XLogP of 2.75, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylsulfanylfuro[2,3-b]furan is sourced from PubChem (CID 123294271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).