(-)-Alpha-terpineol

• Catalog Number: ACM10482561
• Product Name: (-)-Alpha-terpineol
• CAS: 10482-56-1
• Category: Heterocyclic Organic Compound
• Synonyms: 2-(4-Methyl-3-cyclohexen-1-yl)-2-propanol
• IUPAC Name: 2-[(1S)-4-Methylcyclohex-3-en-1-yl]propan-2-ol
• Molecular Weight: 154.25
• Molecular Formula: C10H18O
• Canonical SMILES: CC1=CCC(CC1)C(C)(C)O
• InChI: InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3/t9-/m1/s1
• InChI Key: WUOACPNHFRMFPN-SECBINFHSA-N
• Boiling Point: 217-218 °C(lit.)
• Melting Point: 31-35 °C(lit.)
• Flash Point: 193 °F
• Density: 0.93 g/mL at 25 °C(lit.)
• Solubility: water, 371.7 mg/L @ 25 °C (est)
• Appearance: Solid
• Storage: Store below +30 °C
• Assay: 0.98
• Color/Form: Liquid
• Complexity: 168
• Covalently-Bonded Unit Count: 1
• EC Number: 233-986-8
• Exact Mass: 154.135765193
• Formal Charge: 0
• Hazard Statements: Xi
• H-Bond Acceptor: 1
• H-Bond Donor: 1
• Heavy Atom Count: 11
• Isomeric SMILES: CC1=CC[C@H](CC1)C(C)(C)O
• LogP: 2.98 (LogP)
• MDL Number: MFCD00075926
• Monoisotopic Mass: 154.135765193
• Other Experimental: BP: 81-82 °C @ 4.5 mm Hg; density: 0.9338 @ 20 °C/4 °C; index of refraction: 1.4818; specific optical rotation: +92.45 deg @ 20 °C/D; solidifies @ 31 °C /d-Form/
• Packaging: 1 kg
• Physical State: Liquid
• pKa: 15.09±0.29(Predicted)
• Refractive Index: n20/D 1.482(lit.)
• Rotatable Bond Count: 1
• Safety Description: 26-36-36/37/39
• Stability: Stable under normal temperatures and pressures.
• Storage Conditions: Below +30 °C
• Supplemental Hazard Statements: H315-H319
• Symbol: GHS07
• Topological Polar Surface Area: 20.2 Ų
• UNII: 21M14KDA67
• Vapor Pressure: 5 mm Hg @ 80 to 81 mm Hg
• XLogP3: 1.8