Sodium alpha,alpha,4-Trimethylcyclohex-3-Ene-1-Methanolate
[CAS# 68540-43-2]

Identification

• Name: Sodium alpha,alpha,4-Trimethylcyclohex-3-Ene-1-Methanolate
• Synonyms: 3-Cyclohexene-1-Methanol, Alpha,Alpha,4-Trimethyl-, Sodium Salt; 3-Cyclohexene-1-Methanol, Alpha,Alpha,4-Trimethyl-, Sodium Salt, (1S)-
• Molecular Formula: C₁₀H₁₇NaO
• Molecular Weight: 176.23
• CAS Registry Number: 68540-43-2 (68797-63-7)
• EINECS: 271-304-0
• SMILES: CC1=CCC(CC1)C(C)(C)[O-].[Na+]
• InChI: 1S/C10H17O.Na/c1-8-4-6-9(7-5-8)10(2,3)11;/h4,9H,5-7H2,1-3H3;/q-1;+1
• InChIKey: HYRQFPFINJXYCB-UHFFFAOYSA-N

Properties

• Boiling point: 217.5°C at 760 mmHg (Cal.)
• Flash point: 89.4°C (Cal.)