Pentyl benzeneacetate
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Pentyl benzeneacetate
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CAS No:
5137-52-0
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Formula:
C13H18O2
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Chemical Name:
Pentyl benzeneacetate
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Synonyms:
Benzeneacetic acid,pentyl ester;Acetic acid,phenyl-,pentyl ester;Pentyl benzeneacetate;Pentyl phenylacetate;Amyl phenylacetate;NSC 46135;Pentyl 2-phenylacetate
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CAS No:
Characteristics
26.30000
4.09
1.0±0.1 g/cm3
31-32 °C
269°C(lit.)
107.0±17.1 °C
1.495
14.26 mg/L @ 25 °C (est)
Pentyl benzeneacetate Use and Manufacturing
Benzeneacetic acid, pentyl ester: ACTIVE
Food additives -> Flavoring Agents
Flavoring Agents
Computed Properties
Molecular Weight:206.28
XLogP3:3.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:206.130679813
Monoisotopic Mass:206.130679813
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:171
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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