Hexyl 2-methylbutanoate
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Hexyl 2-methylbutanoate
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CAS No:
10032-15-2
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Formula:
C11H22O2
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Chemical Name:
Hexyl 2-methylbutanoate
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Synonyms:
Butanoic acid,2-methyl-,hexyl ester;Butyric acid,2-methyl-,hexyl ester;Hexyl 2-methylbutyrate;n-Hexyl 2-methylbutyrate;Hexyl 2-methylbutanoate;1-Hexanol 2-methylbutyrate;2-Methylbutyric acid hexyl ester;144810-17-3
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CAS No:
Description
Hexyl 2-methylbutyrate has a strong, green, fruity odor and a sweet, fruity taste reminiscent of unripe strawberry. Hexyl 2-methylbutyrate has a strong, green, fruity odor and a sweet, fruity taste reminiscent of unripe strawberry. May be synthesized by esterification of n-hexanol with 2 -methylbutanoic acid.
colourless liquid/strong, fresh-green, fruity odour
Hexyl 2-methylbutanoate is a butyrate ester. It derives from a hexan-1-ol.
Characteristics
26.3
4.24
0.857 g/mL at 25 °C(lit.)
-63.1°C (estimate)
217-219 °C(lit.)
183 °F
n 20/D 1.4185(lit.)
very slightly|soluble in alcohol, most fixed oils; insoluble in water
0.000815mmHg at 25°C
Safety Information
UN30779/PG3
3
51/53
61
ET5675000
N
P273
H411
|Warning|H226 (38.1%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P273, P280, P303+P361+P353, P370+P378, P391, P403+P235, and P501|Aggregated GHS information provided by 159 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hexyl 2-methylbutanoate Use and Manufacturing
It is formed by esterification of n-hexanol and isovalerate.
It can be used to blend apple, mint and pineapple flavors.
Butanoic acid, 2-methyl-, hexyl ester: ACTIVE
Food additives -> Flavoring Agents|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]
Flavoring Agents
Computed Properties
Molecular Weight:186.29
XLogP3:3.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:186.161979940
Monoisotopic Mass:186.161979940
Topological Polar Surface Area:26.3
Heavy Atom Count:13
Complexity:132
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of Hexyl 2-methylbutanoate
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Business licensed Certified factoryManufactory Supplier of Active Pharm Ingredients,Chemical Catalyst,Pharmaceutical Intermediates,Flavors and Fragrances,Agrochemicals,Chemical Pesticides,Organic Intermediates,OLED IntermediatesInquiryCAS No.: 10032-15-2Grade: Food GradeContent: 99%
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