2-Butenoic acid, 3-methyl-, (3Z)-3-hexen-1-yl ester

Base Information

• Chemical Name: 2-Butenoic acid, 3-methyl-, (3Z)-3-hexen-1-yl ester
• CAS No.: 65416-28-6
• Molecular Formula: C11H18O2
• Molecular Weight: 182.26
• European Community (EC) Number: 265-766-2
• DSSTox Substance ID: DTXSID20867152
• Mol file: 65416-28-6.mol

Synonyms:65416-28-6;DTXSID20867152;Hex-3-en-1-yl 3-methylbut-2-enoate

Chemical Property of 2-Butenoic acid, 3-methyl-, (3Z)-3-hexen-1-yl ester

Chemical Property:

• Vapor Pressure: 0.0306mmHg at 25°C
• Refractive Index: 1.458
• Boiling Point: 244.3 °C at 760 mmHg
• Flash Point: 106.2 °C
• PSA: 26.30000
• Density: 0.908 g/cm³
• LogP: 2.85210
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 182.130679813
• Heavy Atom Count: 13
• Complexity: 198

Purity/Quality:

99% ^*data from raw suppliers

HEXENYL-CIS-3-SENECIOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC=CCCOC(=O)C=C(C)C