Ethyl valerate
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Ethyl valerate
structure -
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CAS No:
539-82-2
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Formula:
C7H14O2
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Chemical Name:
Ethyl valerate
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Synonyms:
Pentanoic acid,ethyl ester;Valeric acid,ethyl ester;Ethyl valerate;Ethyl n-valerate;Ethyl pentanoate;Ethyl n-pentanoate;NSC 8868
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CAS No:
Description
clear colorless liquid Ethyl valerate has a fruity odor suggestive of apple
Liquid|Colourless to pale yellow liquid
Ethyl pentanoate is a fatty acid ester.
Ethyl valerate Basic Attributes
130.18
130.18
1744680
208-726-1
95R258T4P6
8868
DTXSID6040161
29156090
Characteristics
26.3
1.9
Clear colorless Liquid
0.87433 g/cm3 @ Temp: 20 °C
-91.2 °C
146.1 °C
102 °F
1.399-1.401
2.226g/L(temperature not stated)
Flammables area
4.80 mmHg
1%(V)
Safety Information
III
3
UN 3272 3/PG 3
3
10
16
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501
H226
|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 1659 companies from 4 notifications to the ECHA C&L Inventory.
Ethyl valerate Use and Manufacturing
By sodium valerate and ethanol in the presence of sulfuric acid or hydrogen chloride co-esterification, distillation and derived.
Intermediate in perfumery.
Pentanoic acid, ethyl ester: ACTIVE
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]
Flavoring Agents
Computed Properties
Molecular Weight:130.18
XLogP3:1.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:130.099379685
Monoisotopic Mass:130.099379685
Topological Polar Surface Area:26.3
Heavy Atom Count:9
Complexity:79
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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