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Rutin

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Rutin / CAS : 250249-75-3

Appearance Yellow crystalline powder. neat UN 0.0
HS 29381000 DG Class 0.0
Synonyms Rutoside Trihydrate; Quercetin-3-Rutinoside Trihydrate,Vitamin P Trihydrate; Quercetin-3-Rutinoside Trihydrate, Vitamin P Trihydrate; (+)-Rutin Trihydrate Rutoside Rutin; 2-(3,4-Dihydroxyphenyl)-5,7-Dihydroxy-3-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Oxy)Methyl)Tetrahydro-2H-Pyran-2-Yl)Oxy)-4H-Chromen-4-One Trihydrate; 3-[[6-O-(6-Deoxy-Alpha-L-Mannopyranosyl)-Beta-D-Glucopyranosyl]Oxy]-2-(3,4-Dihydroxyphenyl)-5,7-Dihydroxy-4H-1-Benzopyran-4-One Trihydrate; Rutoside Trihydrate Crs; (+)-Rutin Trihydrate
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Properties

Summary

Formula
C20H36O3
Molecular Mass
324.49800
Exact Mass
324.26600
PSA
27.69000
Logp
6.34500
IUPAC
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one;trihydrate
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O.O.O.O

Attribute classification

Matter Classification
organic
Category
Organic Chemical Materials > Hydrocarbons
API & Intermediate > Blood System Drugs
Food(Feed) Additives > Antioxidants

Chemical and Physical Properties

Melting Point
195ºC
Density
1.82g/cm3
Boiling Point
983.1ºC at 760mmHg
Flash Point
325.4ºC
Appearance
Yellow crystalline powder. neat

Export information

HS Code
29381000
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
R22
Safety Label
Xn

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