5-Methyl-2-isopropenylcyclohexyl isovalerate

Base Information

• Chemical Name: 5-Methyl-2-isopropenylcyclohexyl isovalerate
• CAS No.: 71477-80-0
• Molecular Formula: C15H26O2
• Molecular Weight: 238.3657
• DSSTox Substance ID: DTXSID70887901
• Nikkaji Number: J446.823F
• Mol file: 71477-80-0.mol

Synonyms:p-Menth-8-en-3-ol isovalerate;5-Methyl-2-isopropenylcyclohexyl isovalerate;71477-80-0;Butanoic acid, 3-methyl-, 5-methyl-2-(1-methylethenyl)cyclohexyl ester;DTXSID70887901;3-Methylbutanoic acid 5-methyl-2-(1-methylethenyl)cyclohexyl ester

Chemical Property of 5-Methyl-2-isopropenylcyclohexyl isovalerate

Chemical Property:

• Vapor Pressure: 0.00187mmHg at 25°C
• Boiling Point: 292.1°Cat760mmHg
• Flash Point: 122.9°C
• PSA: 57.53000
• Density: 0.92g/cm³
• LogP: 3.47670
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 238.193280068
• Heavy Atom Count: 17
• Complexity: 281

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC(C(C1)OC(=O)CC(C)C)C(=C)C