Butylsulfanylbenzene
[CAS# 1126-80-3]

Identification

• Name: Butylsulfanylbenzene
• Synonyms: (Butylthio)Benzene; 4-Methyl-1-(1-Thiabutyl)Benzene; Benzene, (Butylthio)-
• Molecular Formula: C₁₀H₁₄S
• Molecular Weight: 166.28
• CAS Registry Number: 1126-80-3
• SMILES: C1=C(SCCCC)C=CC=C1
• InChI: 1S/C10H14S/c1-2-3-9-11-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3
• InChIKey: JETFNRIIPBNRAT-UHFFFAOYSA-N

Properties

• Density: 0.979g/cm³ (Cal.)
• Boiling point: 241.721°C at 760 mmHg (Cal.)
• Flash point: 98.327°C (Cal.)

References

• (1): W. Chen, Q.-X. Yin, C. Xie, J.-K. Wang and H. Li. 1,8-Bis(phenylsulfanyl)octane, Acta Cryst. (2004). E60, o2147-o2148