3-Mercapto-2,5-dimethylfuran

CAS	55764-23-3
Structure
Synonyms	2,5-Dimethyl-3-mercaptofuran
IUPAC Name	2,5-Dimethylfuran-3-thiol
Molecular Weight	128.19
Canonical SMILES	CC1=CC(=C(O1)C)S
InChI	InChI=1S/C6H8OS/c1-4-3-6(8)5(2)7-4/h3,8H,1-2H3
InChI Key	DBBHCZMXKBCICL-UHFFFAOYSA-N
Boiling Point	175-177 °C
Flash Point	54 °C
Purity	98%+
Density	1.050-1.090 g/cm³ at 20 °C(lit.)
Exact Mass	128.02958605
Monoisotopic Mass	128.02958605
Physical State	Liquid
Refractive Index	n20/D 1.505-1.515(lit.)
Storage Conditions	Dry place,2-8 °C
Topological Polar Surface Area	14.1 Ų