Cyclohexanol, 2-methyl-5-(1-methylethyl)-, acetate, (1alpha,2beta,5alpha)-

Base Information

• Chemical Name: Cyclohexanol, 2-methyl-5-(1-methylethyl)-, acetate, (1alpha,2beta,5alpha)-
• CAS No.: 5256-66-6
• Molecular Formula: C₁₂H₂₂O₂
• Molecular Weight: 198.305
• European Community (EC) Number: 226-058-9
• DSSTox Substance ID: DTXSID701158049
• Nikkaji Number: J264.844J
• Mol file: 5256-66-6.mol

Synonyms:5256-66-6;Neocarvomenthyl acetate;DTXSID701158049;EINECS 226-058-9;Cyclohexanol, 2-methyl-5-(1-methylethyl)-, acetate, (1alpha,2beta,5alpha)-;AI3-03437;2alpha-Methyl-5beta-(1-methylethyl)cyclohexan-1beta-ol acetate;Cyclohexanol, 2-methyl-5-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel-

Chemical Property of Cyclohexanol, 2-methyl-5-(1-methylethyl)-, acetate, (1alpha,2beta,5alpha)-

Chemical Property:

• Vapor Pressure: 0.0707mmHg at 25°C
• Boiling Point: 229.1°Cat760mmHg
• Flash Point: 94.4°C
• PSA: 26.30000
• Density: 0.92g/cm³
• LogP: 3.01030
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 198.161979940
• Heavy Atom Count: 14
• Complexity: 199

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC(CC1OC(=O)C)C(C)C
• Isomeric SMILES: C[C@@H]1CC[C@H](C[C@H]1OC(=O)C)C(C)C

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