Picein
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Picein
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CAS No:
530-14-3
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Formula:
C14H18O7
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Chemical Name:
Picein
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Synonyms:
Ethanone,1-[4-(β-D-glucopyranosyloxy)phenyl]-;Picein;1-[4-(β-D-Glucopyranosyloxy)phenyl]ethanone;Piceoside;Ameliaroside;p-Hydroxyacetophenone-D-glucoside;Salicinerein;Salinigrin;4-Acetylphenyl β-D-glucopyranoside;p-Hydroxyacetophenone glucoside;1194723-63-1
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CAS No:
Characteristics
116
-0.7
pale yellow solid
1.433 g/cm3
195.5 °C
562.6ºC at 760 mmHg
213.2ºC
1.608
Hygroscopic, -20°C Freezer, Under Inert Atmosphere
D23 -88° (c = 1)
Computed Properties
Molecular Weight:298.29
XLogP3:-0.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:298.10525291
Monoisotopic Mass:298.10525291
Topological Polar Surface Area:116
Heavy Atom Count:21
Complexity:353
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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