4-(1,1-Dimethylethyl)cyclohexylmethyl propanoate

Base Information

• Chemical Name: 4-(1,1-Dimethylethyl)cyclohexylmethyl propanoate
• CAS No.: 85204-30-4
• Molecular Formula: C14H26 O2
• Molecular Weight: 226.35504
• European Community (EC) Number: 286-326-6
• DSSTox Substance ID: DTXSID80234407
• Nikkaji Number: J333.825H
• Mol file: 85204-30-4.mol

Synonyms:85204-30-4;4-(1,1-Dimethylethyl)cyclohexylmethyl propanoate;EINECS 286-326-6;EINECS 264-333-5;EINECS 264-361-8;cis-4-(1,1-Dimethylethyl)-alpha-methylcyclohexylmethyl acetate;trans-4-(1,1-Dimethylethyl)-alpha-methylcyclohexylmethyl acetate;DTXSID80234407;Propionic acid (4-tert-butylcyclohexyl)methyl ester

Chemical Property of 4-(1,1-Dimethylethyl)cyclohexylmethyl propanoate

Chemical Property:

• Vapor Pressure: 0.0154mmHg at 25°C
• Boiling Point: 256.4°C at 760 mmHg
• Flash Point: 109.3°C
• PSA: 26.30000
• Density: 0.917g/cm³
• LogP: 3.79210
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 226.193280068
• Heavy Atom Count: 16
• Complexity: 219

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC(=O)OCC1CCC(CC1)C(C)(C)C