97907-57-8 Purity
96%
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The molecular formula is C11H18OS2.
The molecular weight is 230.4 g/mol.
The IUPAC name is 2-methyl-3,4-bis(propylsulfanyl)furan.
The InChI is InChI=1S/C11H18OS2/c1-4-6-13-10-8-12-9(3)11(10)14-7-5-2/h8H,4-7H2,1-3H3.
The InChIKey is MIXOCJNSBZRZDR-UHFFFAOYSA-N.
The canonical SMILES is CCCSC1=COC(=C1SCCC)C.
The XLogP3-AA value is 4.2.
Bis(propylthio)methyl furan has 0 hydrogen bond donor count.
Bis(propylthio)methyl furan has 3 hydrogen bond acceptor count.
Bis(propylthio)methyl furan has 6 rotatable bond count.