2-Phenylethyl acetate
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2-Phenylethyl acetate
structure -
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CAS No:
103-45-7
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Formula:
C10H12O2
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Chemical Name:
2-Phenylethyl acetate
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Synonyms:
Acetic acid,2-phenylethyl ester;Acetic acid,phenethyl ester;Phenethyl alcohol,acetate;Benzylcarbinyl acetate;Phenethyl acetate;β-Phenylethyl acetate;β-Phenethyl acetate;2-Phenylethyl acetate;2-Phenethyl acetate;Phenylethyl ethanoate;β-Phenylethanol acetate;NSC 71927;2-Phenylethanol acetate;Benzeneethanol acetate
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CAS No:
Description
Liquid
Liquid|Colourless liquid; very sweet, rosy-fruity honey-like odour
Phenethyl acetate is the acetate ester of 2-phenylethanol. It has a role as a metabolite and a Saccharomyces cerevisiae metabolite. It derives from a 2-phenylethanol.
2-Phenylethyl acetate Basic Attributes
164.2
164.20
638179
203-113-5
67733846OW
71927
DTXSID7044506
29153990
Characteristics
26.3
2.3
Liquid
1.0765 g/cm3 @ Temp: 20 °C
-31.1 °C
232.6 °C
215 °F
1.502
H2O: negligible soluble
Store below +30°C.
0.03 mmHg
5.67 (vs air)
Safety Information
Ⅲ
2810
1
36/37/38
24/25-36-26
AJ2220000
Xi
Stable under normal temperatures and pressures.
P264, P280, P305+P351+P338, P310, P33, P313
H318
|Danger|H318 (78.79%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, P310, and P337+P313|Aggregated GHS information provided by 1825 companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2-Phenylethyl acetate Use and Manufacturing
In the presence of sodium acetate, it is derived from the reaction of phenethyl alcohol and acetic anhydride.
The product has a peach aroma, and natural products are found in apples, grapes, berries, tea, tianjiu, beer, whiskey, brandy, etc. It is mainly used as a spice ingredient. It is an indispensable ingredient in rose-type blended spices. In terms of food ingredients, it is mainly used as a spice for honey, cream, and toffee. In addition, it is also used as a fruit essence such as apricot and strawberry.
Odor agents
Air care products
All other chemical product and preparation manufacturing|Acetic acid, 2-phenylethyl ester: ACTIVE
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index|Cosmetics -> Deodorant
Flavoring Agents
Computed Properties
Molecular Weight:164.20
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:164.083729621
Monoisotopic Mass:164.083729621
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:137
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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