1-Methyl-3-(2,6,6-trimethylcyclohex-2-enyl)allyl isobutyrate

Base Information

• Chemical Name: 1-Methyl-3-(2,6,6-trimethylcyclohex-2-enyl)allyl isobutyrate
• CAS No.: 93982-70-8
• Molecular Formula: C17H28 O2
• Molecular Weight: 264.40302
• European Community (EC) Number: 301-260-0
• Nikkaji Number: J348.938H
• Mol file: 93982-70-8.mol

Synonyms:93982-70-8;1-Methyl-3-(2,6,6-trimethylcyclohex-2-enyl)allyl isobutyrate;EINECS 301-260-0;NS00062262

Chemical Property of 1-Methyl-3-(2,6,6-trimethylcyclohex-2-enyl)allyl isobutyrate

Chemical Property:

• Vapor Pressure: 0.000284mmHg at 25°C
• Boiling Point: 322.2°Cat760mmHg
• Flash Point: 91.9°C
• PSA: 26.30000
• Density: 0.948g/cm³
• LogP: 4.51280
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 264.208930132
• Heavy Atom Count: 19
• Complexity: 375

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CCCC(C1C=CC(C)OC(=O)C(C)C)(C)C
• Isomeric SMILES: CC1=CCCC(C1/C=C/C(C)OC(=O)C(C)C)(C)C