Listerine
[CAS# 51273-66-6]

Identification

• Name: Listerine
• Synonyms: 2-Isopropyl-5-Methyl-Cyclohexan-1-Ol; 2-Isopropyl-5-Methyl-Phenol; 4,7,7-Trimethyl-8-Oxabicyclo[2.2.2]Octane; 2-Isopropyl-5-Methyl-1-Cyclohexanol; 2-Isopropyl-5-Methylphenol; 4,7,7-Trimethyl-8-Oxabicyclo[2.2.2]Octane
• Molecular Formula: C₃₀H₅₂O₃
• Molecular Weight: 460.74
• CAS Registry Number: 51273-66-6
• SMILES: CC12OC(C(CC1)CC2)(C)C.C3=CC(=CC(=C3C(C)C)O)C.CC(C4C(O)CC(CC4)C)C
• InChI: 1S/C10H18O.C10H20O.C10H14O/c1-9(2)8-4-6-10(3,11-9)7-5-8;2*1-7(2)9-5-4-8(3)6-10(9)11/h8H,4-7H2,1-3H3;7-11H,4-6H2,1-3H3;4-7,11H,1-3H3
• InChIKey: CSAVDNHVPJNKTC-UHFFFAOYSA-N

Properties

• Boiling point: 215.4°C at 760 mmHg (Cal.)
• Flash point: 93.3°C (Cal.)