Ethylvanillin isobutyrate
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Ethylvanillin isobutyrate
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CAS No:
188417-26-7
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Formula:
C13H16O4
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Chemical Name:
Ethylvanillin isobutyrate
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Synonyms:
Propanoic acid,2-methyl-,2-ethoxy-4-formylphenyl ester;4-Isobutanoyloxy-3-ethoxybenzaldehyde;Ethylvanillin isobutyrate;2-Ethoxy-4-formylphenyl 2-methylpropanoate;2-Ethoxy-4-formylphenyl isobutyrate
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CAS No:
Description
white to light yellow powder
Ethyl vanillin isobutyrate is a member of the class of benzaldehydes that is benzaldehyde substituted by an ethoxy group at position 3 and by a (2-methylpropanoyl)oxy group at position 4. It has a role as a flavouring agent. It is an aromatic ether, a member of benzaldehydes and a carboxylic ester.
Characteristics
52.6
2.5
white to light yellow powder
1.111±0.06 g/cm3(Predicted)
45-46 °C @ Solvent: Benzene, Hexane
328.5±27.0 °C(Predicted)
142.4±23.8 °C
1.522
insoluble in water; soluble in organic solvents, oils
0.000884mmHg at 25°C
Safety Information
P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P501
H317
|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, and P501|Aggregated GHS information provided by 113 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Ethylvanillin isobutyrate Use and Manufacturing
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:236.26
XLogP3:2.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:236.10485899
Monoisotopic Mass:236.10485899
Topological Polar Surface Area:52.6
Heavy Atom Count:17
Complexity:262
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of Ethylvanillin isobutyrate
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