2,3-Butanedithiol

• CAS: 4532-64-3
• Catalog Number: ACM-MO-4532643
• Category: Other Products; Dithiol Monomers
• Molecular Weight: 122.24 g/mol
• Molecular Formula: C4H10S2
• Synonyms: 2,3-Dimercaptobutane
• IUPAC Name: Butane-2,3-dithiol
• Canonical SMILES: CC(C(C)S)S
• InChI: InChI=1S/C4H10S2/c1-3(5)4(2)6/h3-6H,1-2H3
• InChI Key: TWWSEEHCVDRRRI-UHFFFAOYSA-N
• Boiling Point: 87 °C/50 mmHg
• Melting Point: -53.9 °C
• Flash Point: 52 °C
• Density: 0.995 g/mL at 25 °C(lit.)
• Solubility: insoluble in water; miscble in fat
• Appearance: Colorless to Light Yellow to Light Orange Clear Liquid
• Complexity: 30.5
• Condition To Avoid: Air Sensitive
• Covalently-Bonded Unit Count: 1
• EC Number: 224-870-8
• Exact Mass: 122.02239267
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• Heavy Atom Count: 6
• Monoisotopic Mass: 122.02239267
• Physical State: Liquid
• Refractive Index: 1.52
• Rotatable Bond Count: 1
• Specific Gravity: 1.03
• Topological Polar Surface Area: 2 Ų
• UNII: 69G298U39K
• XLogP3: 1.7