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ChemicalBook--->CAS DataBase List--->52438-12-7

52438-12-7

52438-12-7 Structure

52438-12-7 Structure
IdentificationBack Directory
[Name]

ISOBUTYRYLSHIKONIN
[CAS]

52438-12-7
[Synonyms]

Isobutylshikonin
ISOBUTYRYLSHIKONIN
Isobutyroylshikonin
5,8-DIHYDROXY-2-(1-ISOBUTYRYLOXY-4-METHYL-3-PENTENYL)-1,4-NAPHTHALENEDIONE
2-[1-(Isobutyryloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-1,4-naphthoquinone
(R)-1-(1,4-Dihydro-5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methyl-3-pentenyl=isobutyrate
(R)-2-Methyl-propanoic acid 1-(1,4-dihydro-5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)-4-methyl-3-pentenyl ester
2-Methylpropanoic acid (R)-1-[(1,4-dioxo-5,8-dihydroxy-1,4-dihydronaphthalene)-2-yl]-4-methyl-3-pentenyl ester
Propanoic acid, 2-methyl-, (1R)-1-(1,4-dihydro-5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)-4-methyl-3-penten-1-yl ester
[EINECS(EC#)]

932-567-3
[Molecular Formula]

C20H22O6
[MDL Number]

MFCD00144512
[MOL File]

52438-12-7.mol
[Molecular Weight]

358.39
Chemical PropertiesBack Directory
[Melting point ]

88 °C
[Boiling point ]

561.9±50.0 °C(Predicted)
[density ]

1.269±0.06 g/cm3(Predicted)
[solubility ]

Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
[form ]

Powder
[pka]

7.05±0.20(Predicted)
[color ]

Brown to black
[LogP]

3.563 (est)
Hazard InformationBack Directory
[Definition]

ChEBI: Isobutylshikonin is a hydroxy-1,4-naphthoquinone.
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