1-Cyclohexylethyl 2-butenoate

Base Information

• Chemical Name: 1-Cyclohexylethyl 2-butenoate
• CAS No.: 68039-69-0
• Deprecated CAS: 514828-01-4
• Molecular Formula: C12H20O2
• Molecular Weight: 196.286
• European Community (EC) Number: 268-276-7
• Nikkaji Number: J1.978.946B,J288.970F
• Mol file: 68039-69-0.mol

Synonyms:EINECS 268-276-7;1-Cyclohexylethyl 2-butenoate;2-Butenoicacid, 1-cyclohexylethyl ester;68039-69-0;Cyclohexyl methyl carbinol crotonate;1 - cyclohexylethyl 2 - butenoate;SCHEMBL271977;SCHEMBL271978;2-Butenoicacid,1-cyclohexylethyl ester;(E)-2-Butenoic acid 1-cyclohexylethyl ester;2-BUTENOIC ACID 1-CYCLOHEXYLETHYL ESTER

Chemical Property of 1-Cyclohexylethyl 2-butenoate

Chemical Property:

• Vapor Pressure: 0.0118mmHg at 25°C
• Refractive Index: 1.47
• Boiling Point: 261 °C at 760 mmHg
• Flash Point: 122.4 °C
• PSA: 26.30000
• Density: 0.956 g/cm³
• LogP: 3.07450
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 196.146329876
• Heavy Atom Count: 14
• Complexity: 202

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CC(=O)OC(C)C1CCCCC1
• Isomeric SMILES: C/C=C/C(=O)OC(C)C1CCCCC1

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