(2R)-2-Chlorobutane
[CAS# 22157-31-9]

Identification

• Name: (2R)-2-Chlorobutane
• Molecular Formula: C₄H₉Cl
• Molecular Weight: 92.57
• CAS Registry Number: 22157-31-9
• SMILES: C[C@@H](Cl)CC
• InChI: 1S/C4H9Cl/c1-3-4(2)5/h4H,3H2,1-2H3/t4-/m1/s1
• InChIKey: BSPCSKHALVHRSR-SCSAIBSYSA-N

Properties

• Density: 0.871g/cm³ (Cal.)
• Boiling point: 69.227°C at 760 mmHg (Cal.)
• Flash point: -15°C (Cal.)
• Refractive index: 1.393 (Cal.)

References

• (1): E. L. Willighagen, H. M. G. W. Denissen, R. Wehrens, and L. M. C. Buydens. On the Use of 1H and 13C 1D NMR Spectra as QSPR Descriptors, J. Chem. Inf. Model., 46 (2), 487-494, 2006