25941-24-6

Basic information

• Product Name: (3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one
• Synonyms: (3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one;Pleniradin
• CAS NO: 25941-24-6
• Molecular Formula: C15H20O4
• Molecular Weight: 264.3169
• Mol File: 25941-24-6.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 475.6°C at 760 mmHg
• Flash Point: 179.9°C
• Appearance: /
• Density: 1.26g/cm³
• Vapor Pressure: 4.82E-11mmHg at 25°C
• Refractive Index: 1.576
• PKA: 14.40±0.60(Predicted)
• CAS DataBase Reference: (3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one(CAS DataBase Reference)
• NIST Chemistry Reference: (3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one(25941-24-6)
• EPA Substance Registry System: (3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one(25941-24-6)

Safety Data

• Hazardous Substances Data: 25941-24-6(Hazardous Substances Data)

Usage

Description

(3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one is a complex organic molecule with a unique fused ring structure. It features multiple hydroxy groups, a methylene group, a furan ring, and a lactone ring. (3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one's three-dimensional configuration is characterized by multiple stereocenters, indicated by the letters α and β. The presence of these functional groups and the intricate ring system suggest that this compound may possess specific pharmaceutical or biological activities, likely due to its interactions with biological targets. Additionally, the lactone ring indicates potential for lactonization reactions, which could influence the compound's chemical reactivity and behavior within biological systems.

Uses

Used in Pharmaceutical Industry:
(3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one is used as a potential pharmaceutical agent for its possible interaction with biological targets. (3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one's complex structure and multiple functional groups may contribute to its efficacy in treating specific medical conditions or diseases.
Used in Chemical Research:
In the field of chemical research, (3aR)-3aα,4,4aα,5,6,7,7aβ,9aα-Octahydro-5α,7α-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one serves as a subject for studying the properties and reactivity of complex organic molecules. Its potential for lactonization reactions and the presence of multiple stereocenters make it an interesting candidate for investigations into stereochemistry and the development of novel synthetic pathways.

InChI:InChI=1/C15H20O4/c1-7-4-12-9(8(2)14(17)19-12)5-10-13(7)11(16)6-15(10,3)18/h4,9-13,16,18H,2,5-6H2,1,3H3/t9-,10-,11+,12-,13-,15-/m1/s1