Butyl mandelate
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Butyl mandelate
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CAS No:
14007-02-4
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Formula:
C12H16O3
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Chemical Name:
Butyl mandelate
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Synonyms:
Benzeneacetic acid,α-hydroxy-,butyl ester;Mandelic acid,butyl ester;Butyl mandelate;AI 3-1789;NSC 406147;Butyl 2-hydroxy-2-phenylacetate;(±)-n-Butyl mandelate;119718-90-0
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CAS No:
Computed Properties
Molecular Weight:208.25
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:208.109944368
Monoisotopic Mass:208.109944368
Topological Polar Surface Area:46.5
Heavy Atom Count:15
Complexity:185
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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