2-Methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate

Base Information

• Chemical Name: 2-Methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate
• CAS No.: 72727-56-1
• Molecular Formula: C18H30 O2
• Molecular Weight: 278.4296
• European Community (EC) Number: 276-789-2
• DSSTox Substance ID: DTXSID30888171
• Nikkaji Number: J296.356F
• Mol file: 72727-56-1.mol

Synonyms:72727-56-1;EINECS 276-789-2;2-Methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate;1-Methyl-3-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylic acid, 2-methylpropyl ester;3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-penten-1-yl)-, 2-methylpropyl ester;3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-pentenyl)-, 2-methylpropyl ester;DTXSID30888171;1-Methyl-3-(4-methyl-3-pentenyl)-3-cyclohexene-1-carboxylic acid 2-methylpropyl ester;3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-pentenyl)-,2-methylpropyl ester

Chemical Property of 2-Methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate

Chemical Property:

• Vapor Pressure: 8.47E-05mmHg at 25°C
• Boiling Point: 340.7°C at 760 mmHg
• Flash Point: 153.3°C
• PSA: 26.30000
• Density: 0.925g/cm³
• LogP: 5.04860
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 278.224580195
• Heavy Atom Count: 20
• Complexity: 386

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)COC(=O)C1(CCC=C(C1)CCC=C(C)C)C