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Trans-Isocohumulone

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Trans-Isocohumulone / CAS : 58501-77-2

Appearance - UN -
HS 29145090 DG Class -
Synonyms Isocohumulone,Trans-; 2-Cyclopenten-1-one,3,4-Dihydroxy-5-(3-Methyl-2-Butenyl)-4-(4-Methyl-1-oxo-3-Pentenyl)-2-(2-Methyl-1-Oxopropyl)-,Trans-; 2-Cyclopenten-1-one,3,4-Dihydroxy-5-(3-Methyl-2-Buten-1-yl)-4-(4-Methyl-1-oxo-3-Penten-1-yl)-2-(2-Methyl-1-Oxopropyl)-,(4R,5R)-rel-; 2-Cyclopenten-1-one,3,4-Dihydroxy-5-(3-Methyl-2-Butenyl)-4-(4-Methyl-1-oxo-3-Pentenyl)-2-(2-Methyl-1-Oxopropyl)-,(4R,5R)-rel-
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Properties

Summary

Formula
C20H28O5
Molecular Mass
348.43300
Exact Mass
348.19400
PSA
91.67000
Logp
3.23530
IUPAC
(4R,5R)-3,4-dihydroxy-5-(3-methylbut-2-enyl)-4-(4-methylpent-3-enoyl)-2-(2-methylpropanoyl)cyclopent-2-en-1-one
SMILES
CC(C)C(=O)C1=C([C@]([C@H](C1=O)CC=C(C)C)(C(=O)CC=C(C)C)O)O

Attribute classification

Matter Classification
organic
Category
Plant and Other Extracts > Plant Extracts
Organic Chemical Materials > Aldehydes, Ketones and Quinones

Chemical and Physical Properties

Density
1.150±0.06 g/cm3(Predicted)
Boiling Point
520.1±50.0 °C(Predicted)
Acidity and Basicity
neutral

Export information

HS Code
29145090
Export Rebate
13%

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