Benzylisopropyl propionate

Base Information

• Chemical Name: Benzylisopropyl propionate
• CAS No.: 67785-77-7
• Molecular Formula: C13H18O2
• Molecular Weight: 206.31
• European Community (EC) Number: 267-072-5
• DSSTox Substance ID: DTXSID90867326
• Nikkaji Number: J260.933I
• Wikidata: Q63392131
• Mol file: 67785-77-7.mol

Synonyms:Benzylisopropyl propionate;67785-77-7;dimethyl benzyl carbinyl propionate;Dimethylbenzylcarbinyl propionate;(2-methyl-1-phenylpropan-2-yl) propanoate;benzylisopropyl propanoate;EINECS 267-072-5;alpha,alpha-Dimethylphenethyl propionate;alpha,alpha-Dimethylbenzeneethanol, propionate;Benzeneethanol, alpha,alpha-dimethyl-, propanoate;Propanoic acid, 1,1-dimethyl-2-phenylethyl ester;Phenethyl alcohol, alpha,alpha-dimethyl-, propionate;Propanoic acid, (3-phenyl-2-methyl-2-propyl) ester;Benzeneethanol, .alpha.,.alpha.-dimethyl-, propanoate;Benzene ethanol, alpha,alpha-dimethyl-, propanoate;Benzeneethanol, alpha,alpha-dimethyl-, 1-propanoate;benzyl isopropyl propionate;SCHEMBL872678;DTXSID90867326;a,a - dimethylphenethyl propionate;1,1-Dimethyl-2-phenylethyl propionate;1,1-Dimethyl-2-phenylethyl=propionate;2-methyl-1-phenylpropan-2-yl propionate;1,1-Dimethyl-2-phenylethyl propionate #;alpha,alpha-Dimethylphenylethyl propionate;LS-30291;Benzeneethanol, ?,?-dimethyl-, propanoate;Q63392131;Benzeneethanol, .alpha.,.alpha.-dimethyl-, 1-propanoate;Phenethyl alcohol, .alpha.,.alpha.-dimethyl-, propionate

Chemical Property of Benzylisopropyl propionate

Chemical Property:

• Vapor Pressure: 0.00484mmHg at 25°C
• Refractive Index: 1.494
• Boiling Point: 276.3 °C at 760 mmHg
• Flash Point: 104.2 °C
• PSA: 26.30000
• Density: 0.99 g/cm³
• LogP: 2.96090
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 206.130679813
• Heavy Atom Count: 15
• Complexity: 203

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCC(=O)OC(C)(C)CC1=CC=CC=C1