Benzeneethanol, β-methyl-, 1-acetate
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Benzeneethanol, β-methyl-, 1-acetate
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CAS No:
10402-52-5
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Formula:
C11H14O2
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Chemical Name:
Benzeneethanol, β-methyl-, 1-acetate
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Synonyms:
Benzeneethanol,β-methyl-,1-acetate;Phenethyl alcohol,β-methyl-,acetate;Benzeneethanol,β-methyl-,acetate;Hydratropyl acetate;2-Phenyl-1-propanol acetate;NSC 190972;2-Phenylpropyl acetate;2-Phenylpropyl ethanoate;144939-28-6
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CAS No:
Characteristics
26.3
2.35320
colorless liquid
1.0171 g/cm3 @ Temp: 20 °C
103-105 °C @ Press: 10 Torr
99.1ºC
1.5103 (estimate)
0.0389mmHg at 25°C
The acute oral LD 50 value in rats was reported as 4.3g/kg (3.46-5.14 g/kg) and the acute dermal LD 50 value in rabbits exceeded 5 g/kg (Moreno, 1975).
Benzeneethanol, β-methyl-, 1-acetate Use and Manufacturing
Benzeneethanol, .beta.-methyl-, 1-acetate: ACTIVE
Computed Properties
Molecular Weight:178.23
XLogP3:2.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:178.099379685
Monoisotopic Mass:178.099379685
Topological Polar Surface Area:26.3
Heavy Atom Count:13
Complexity:160
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Benzeneethanol, β-methyl-, 1-acetate
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