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(4ar,6as,9as,9bs)-6a-Methyloctahydrocyclopenta[F]Chromene-3,7(2h,8h)-Dione

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(4aR,6aS,9aS,9bS)-6a-Methyloctahydrocyclopenta[f]Chromene-3,7(2H,8H)-Dione / CAS : 126784-20-1

Appearance - UN -
HS 29349990 DG Class -
Synonyms Cyclopenta[f][1]Benzopyran-3,7-Dione,Decahydro-6a-Methyl-,[4aR-(4aα,6aα,9aβ,9bα)]-; Sitolactone; 3aα-H-4α-[3'-Propionic acid]-5α-Hydroxy-7aβ-Methyl-Hexahydro-1-Indanone-δ-Lactone; Cyclopenta[f][1]Benzopyran-3,7-Dione,Decahydro-6a-Methyl-,(4aR,6aS,9aS,9bS)-; Delta-Lactone
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Properties

Summary

Formula
C13H18O3
Molecular Mass
222.28000
Exact Mass
222.12600
PSA
43.37000
Logp
2.08740
IUPAC
(4aR,6aS,9aS,9bS)-6a-methyl-2,4a,5,6,8,9,9a,9b-octahydro-1H-cyclopenta[f]chromene-3,7-dione
SMILES
C[C@]12CC[C@@H]3[C@H]([C@@H]1CCC2=O)CCC(=O)O3

Attribute classification

Category
Organic Chemical Materials > Aldehydes, Ketones and Quinones

Chemical and Physical Properties

Melting Point
119 - 121 °C
Density
1.161±0.06 g/cm3(Predicted)
Boiling Point
389.4±42.0 °C(Predicted)

Export information

HS Code
29349990
Export Rebate
13%

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