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Genipin

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Genipin / CAS : 6902-77-8

Appearance White crystalline powder UN 2811
HS 29329990 DG Class 6.1
Synonyms Methyl (1R,2R,6S)-2-Hydroxy-9-(Hydroxymethyl)-3-Oxabicyclo[4.3.0]Nona-4,8-Diene-5-Carboxylate; Cyclopenta(C)Pyran-4-Carboxylicacid,1,4A-Alpha,5,7A-Alpha-Tetrahydro-1-Hydrox; 1,4A,5,7A-Tetrahydro-1-Hydroxy-7-(Hydroxymethyl)-Cyclopenta(C)Pyran-4-Carboxylic Acid Methyl Ester; (1R)-1,4Aα,5,7Aα-Tetrahydro-1-Hydroxy-7-Hydroxymethylcyclopenta[C]Pyran-4-Carboxylic Acid Methyl Ester; (1R)-1,4Aα,5,7Aα-Tetrahydro-1α-Hydroxy-7-Hydroxymethylcyclopenta[C]Pyran-4-Carboxylic Acid Methyl Ester; Enipin; (+)-Genipin
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Properties

Summary

Formula
C11H14O5
Molecular Mass
226.22600
Exact Mass
226.08400
PSA
75.99000
Logp
-0.05330
IUPAC
methyl (1R,4aS,7aS)-1-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
SMILES
COC(=O)C1=COC(C2C1CC=C2CO)O

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Biochemicals
Plant and Other Extracts > Herbal Drugs Preparation

Chemical and Physical Properties

Melting Point
106-108 °C
Density
1.35 g/cm3
Boiling Point
416ºC at 760 mmHg
Flash Point
164.9ºC
Appearance
White crystalline powder
Acidity and Basicity
neutral

Export information

HS Code
29329990
Export Rebate
13%
UN No.
2811
DG-Class
6.1
Risk Code
R22
Safety Label
Xn

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