2-Phenylpropyl 2-methylpropanoate
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2-Phenylpropyl 2-methylpropanoate
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CAS No:
65813-53-8
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Formula:
C13H18O2
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Chemical Name:
2-Phenylpropyl 2-methylpropanoate
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Synonyms:
Propanoic acid,2-methyl-,2-phenylpropyl ester;2-Phenylpropyl 2-methylpropanoate;2-Phenylpropyl isobutyrate
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CAS No:
Characteristics
26.3 Ų
3.515 (est)
0.971-0.977
270.00to271.00°C.@760.00mmHg
1.482-1.488
19.04 mg/L @ 25 °C (est)|Soluble in oils; Insoluble in water|Soluble (in ethanol)
2-Phenylpropyl 2-methylpropanoate Use and Manufacturing
Propanoic acid, 2-methyl-, 2-phenylpropyl ester: INACTIVE
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:206.28
XLogP3:3.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:206.130679813
Monoisotopic Mass:206.130679813
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:193
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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