3-Mercapto-2-butanol

• CAS: 54812-86-1
• Catalog Number: ACM54812861
• Category: Other Products
• Molecular Weight: 106.19
• Molecular Formula: C₄H₁₀OS
• Synonyms: 2-Hydroxy-3-butanethiol
• IUPAC Name: 3-Sulfanylbutan-2-ol
• Canonical SMILES: CC(C(C)S)O
• InChI: InChI=1S/C4H10OS/c1-3(5)4(2)6/h3-6H,1-2H3
• InChI Key: MJQWABQELVFQJL-UHFFFAOYSA-N
• Boiling Point: 59-61 °C
• Melting Point: -100 °C
• Flash Point: 143 °F
• Density: 0.999 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water; miscible in alcohol and fat
• Exact Mass: 106.04523611
• Monoisotopic Mass: 106.04523611
• Physical State: Liquid
• Refractive Index: n20/D 1.48(lit.)
• Topological Polar Surface Area: 21.2 Ų