(1alpha,2beta,5alpha)-2-Methyl-5-(1-Methylethyl)Bicyclo[3.1.0]Hexan-2-Ol
[CAS# 15537-55-0]

Identification

• Name: (1alpha,2beta,5alpha)-2-Methyl-5-(1-Methylethyl)Bicyclo[3.1.0]Hexan-2-Ol
• Synonyms: 1-Isopropyl-4-Methyl-Bicyclo[3.1.0]Hexan-4-Ol; 1-Isopropyl-4-Methyl-4-Bicyclo[3.1.0]Hexanol; 4-Methyl-1-Propan-2-Yl-Bicyclo[3.1.0]Hexan-4-Ol
• Molecular Formula: C₁₀H₁₈O
• Molecular Weight: 154.25
• CAS Registry Number: 15537-55-0 (17699-16-0)
• EINECS: 239-584-9
• SMILES: CC(C12C(C1)C(CC2)(C)O)C
• InChI: 1S/C10H18O/c1-7(2)10-5-4-9(3,11)8(10)6-10/h7-8,11H,4-6H2,1-3H3
• InChIKey: KXSDPILWMGFJMM-UHFFFAOYSA-N

Properties

• Density: 1.03g/cm³ (Cal.)
• Boiling point: 201.703°C at 760 mmHg (Cal.)
• Flash point: 80.103°C (Cal.)
• Refractive index: 1.443 (Expl.)

References

• (1): Over et al.. Natural-product-derived fragments for fragment-based ligand discovery, Nature Chemistry, 2012