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2-Phenylpropyl acetate

2-Phenylpropyl acetate Structure
CAS No.
10402-52-5
Chemical Name:
2-Phenylpropyl acetate
Synonyms
2-phenylpropyl;Hydratropic acetate;HYDRATROPYL ACETATE;2-Phenylpropylacetat;2-PHENYL PROPYL ACETATE;2-Phenyl-1-Propyl Acetate;2-Phenyl-1-propanol acetate;beta-methylphenylethylacetate;Acetic acid 2-phenylpropyl ester;beta-methyl-benzeneethanoacetate
CBNumber:
CB0480358
Molecular Formula:
C11H14O2
Molecular Weight:
178.23
MOL File:
10402-52-5.mol
Modify Date:
2024/6/25 10:34:08

2-Phenylpropyl acetate Properties

Boiling point 270.46°C (rough estimate)
Density 1.0292 (rough estimate)
refractive index 1.5103 (estimate)
color A colourless liquid.
Odor at 100.00 %. sweet hyacinth lilac green earthy
Odor Type floral
LogP 2.652 (est)
NIST Chemistry Reference Benzeneethanol, «beta»-methyl-, acetate(10402-52-5)
EPA Substance Registry System Benzeneethanol, .beta.-methyl-, acetate (10402-52-5)

SAFETY

Risk and Safety Statements

Toxicity The acute oral LD50 value in rats was reported as 4.3g/kg (3.46-5.14 g/kg) and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Moreno, 1975).

2-Phenylpropyl acetate Chemical Properties,Uses,Production

Chemical Properties

Colorless liquid. Sp.Gr. 1.07. Almost insoluble in water, soluble in alcohol, miscible with oils. Fairly soluble in Propylene glycol. Fresh-floral, powerful and fruity-green, slightly earthy-green odor more delicate than Phenylethylacetate, not as rosy, more Hyacinth-Lilac-like. Irsspite of its power, or rather “lift”, its effect is almost a delicate one, enabling the perfumer to use 2-4-6% of this ester in floral bases where green or greenearthy or spicy notes are already composed or called for.

Occurrence

Has apparently not been reported to occur in nature.

Preparation

By direct esterification of hydratropyl alcohol with acetic acid under azeotropic conditions, or with acetic anhydride (Arctander, 1969).

Metabolism

Racemic hydratropic acetate was asymmetrically hydrolysed by Bacillus subtilis var. niger to form ( — )-2-phenylpropanol and ( + )-2-phenylpropyl acetate (Oritani & Yamashita, 1973).

2-Phenylpropyl acetate Preparation Products And Raw materials

Raw materials

Preparation Products

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beta-methylphenylethylacetate HYDRATROPYL ACETATE 2-PHENYL PROPYL ACETATE 2-Phenyl-1-Propyl Acetate 2-Phenylpropylacetat beta-Methylphenethyl alcohol acetate 2-Phenyl-1-propanol acetate Acetic acid 2-phenylpropyl ester Acetic acid β-methylphenethyl ester Hydratropic acetate 2-phenylpropyl Benzeneethanol,.beta.-methyl-,acetate beta-methyl-benzeneethanoacetate beta-methyl-phenethylalcohoacetate Benzeneethanol, β-methyl-, 1-acetate 2-Phenylpropyl acetate USP/EP/BP Benzeneethanol, b-methyl-, 1-acetate 10402-52-5