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3012-76-8

3012-76-8 Structure

3012-76-8 Structure
IdentificationBack Directory
[Name]

(2E,4E,6E)-7-(4,4,7a-trimethyl-2,5,6,7-tetrahydrobenzofuran-2-yl)-3-me thyl-octa-2,4,6-trienoic acid
[CAS]

3012-76-8
[Synonyms]

5,8-Epoxytretinoin
Tretinoin Impurity 10
5,8-Monoepoxyretinoic acid
all-trans 5,8-Epoxy Retinoic Acid
5,8-Dihydro-5,8-epoxyretinoic acid
5,8-Epoxy-5,8-dihydroretinoic acid
Retinoic acid, 5,8-epoxy-5,8-dihydro-
all-trans 5,8-Epoxy Retinoic Acid (Mixture of Diastereomers)
5,8-Epoxy-all-trans-Retinoic Acid (Mixture of DiastereoMers)
(2E,4E,6E)-7-(4,4,7a-trimethyl-2,5,6,7-tetrahydrobenzofuran-2-yl)-3-me thyl-octa-2,4,6-trienoic acid
(2E,4E,6E)-3-methyl-7-(4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydrobenzofuran-2-yl)octa-2,4,6-trienoic acid
2,4,6-Octatrienoic acid, 7-(2,4,5,6,7,7a-hexahydro-4,4,7a-trimethyl-2-benzofuranyl)-3-methyl-, (2E,4E,6E)-
[Molecular Formula]

C20H28O3
[MOL File]

3012-76-8.mol
[Molecular Weight]

316.43
Chemical PropertiesBack Directory
[Melting point ]

154-156°C
[Boiling point ]

466.1±45.0 °C(Predicted)
[density ]

1.07±0.1 g/cm3(Predicted)
[storage temp. ]

Amber Vial, -86°C Freezer, Under Inert Atmosphere
[solubility ]

DCM, Ethyl Acetate, Ether
[form ]

Solid
[pka]

4.72±0.33(Predicted)
[color ]

Light Yellow to Yellow
Hazard InformationBack Directory
[Chemical Properties]

Yellow Solid
[Uses]

5,8-Monoepoxyretinoic Acid is an impurity in the synthesis of Ro 22-5112 (R637180), a retinoid that has been used in a QSAR analysis for the use of retinoids as a carcinogenesis inhibitor.
[Uses]

A metabolite of all-trans Retinoic acid (R250200).
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