1-Methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylic acid

Base Information

• Chemical Name: 1-Methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylic acid
• CAS No.: 65652-27-9
• Molecular Formula: C14H22O2
• Molecular Weight: 222.32328
• European Community (EC) Number: 265-853-5
• DSSTox Substance ID: DTXSID90886779
• Nikkaji Number: J307.449H

Synonyms:65652-27-9;1-Methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylic acid;3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-pentenyl)-;EINECS 265-853-5;3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-penten-1-yl)-;SCHEMBL3973447;DTXSID90886779

Chemical Property of 1-Methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylic acid

Chemical Property:

• Vapor Pressure: 2.63E-05mmHg at 25°C
• Boiling Point: 333.4°C at 760 mmHg
• Flash Point: 161.2°C
• PSA: 37.30000
• Density: 0.986g/cm³
• LogP: 3.93400
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 222.161979940
• Heavy Atom Count: 16
• Complexity: 322

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC1=CCCC(C1)(C)C(=O)O)C

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