3-Mercapto-2,5-hexanedione

CAS	53670-54-5
Structure
IUPAC Name	3-Sulfanylhexane-2,5-dione
Molecular Weight	146.21
Canonical SMILES	CC(=O)CC(C(=O)C)S
InChI	InChI=1S/C6H10O2S/c1-4(7)3-6(9)5(2)8/h6,9H,3H2,1-2H3
InChI Key	YPNPZUSZZOLTIJ-UHFFFAOYSA-N
Boiling Point	236 °C
Flash Point	97 °C
Purity	95%+
Density	1.073 g/mL at 25 °C(lit.)
Exact Mass	146.04015073
Monoisotopic Mass	146.04015073
Topological Polar Surface Area	35.1 Ų