667938-64-9

Basic information

• Product Name: 1,3a-Methano-3aH-indene-3,8-diol, octahydro-8-(hydroxymethyl)-7a-methyl-, (1R,3R,3aR,7aR,8R)-rel- (9CI)
• Synonyms: 1,3a-Methano-3aH-indene-3,8-diol, octahydro-8-(hydroxymethyl)-7a-methyl-, (1R,3R,3aR,7aR,8R)-rel- (9CI)
• CAS NO: 667938-64-9
• Molecular Formula: C12H20O3
• Molecular Weight: 212.2854
• Product Categories: ALCOHOL
• Mol File: 667938-64-9.mol

Chemical Properties

• Appearance: /
• CAS DataBase Reference: 1,3a-Methano-3aH-indene-3,8-diol, octahydro-8-(hydroxymethyl)-7a-methyl-, (1R,3R,3aR,7aR,8R)-rel- (9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: 1,3a-Methano-3aH-indene-3,8-diol, octahydro-8-(hydroxymethyl)-7a-methyl-, (1R,3R,3aR,7aR,8R)-rel- (9CI)(667938-64-9)
• EPA Substance Registry System: 1,3a-Methano-3aH-indene-3,8-diol, octahydro-8-(hydroxymethyl)-7a-methyl-, (1R,3R,3aR,7aR,8R)-rel- (9CI)(667938-64-9)

Safety Data

• Hazardous Substances Data: 667938-64-9(Hazardous Substances Data)

Usage

Chemical class

Complex chemical compound
1,3a-Methano-3aH-indene-3,8-diol, octahydro-8-(hydroxymethyl)-7a-methyl-, (1R,3R,3aR,7aR,8R)-rel- (9CI) is a complex structure with multiple functional groups and stereochemistry.

Derivative

Octahydroindene
It is derived from the octahydroindene class of compounds, which are known for their potential pharmaceutical properties.

Molecular structure

Unique with multiple hydroxyl and methyl groups
The compound has a distinct molecular structure that includes hydroxyl (-OH) and methyl (-CH3) groups, which contribute to its potential applications.

Stereochemistry

(1R,3R,3aR,7aR,8R)-rel-
The stereochemistry of the compound is defined by the specific arrangement of its atoms in three-dimensional space, which is crucial for its potential biological activities.

Potential applications

Pharmaceutical and medicinal properties
The compound has potential applications in drug development, particularly in the treatment of various diseases and conditions.

Research and studies

Further research needed
More research and studies are required to fully understand the compound's potential and harness it for therapeutic purposes.

CAS Registry Number

9CI
The compound is registered under the Chemical Abstracts Service (CAS) with the identifier 9CI, which is a unique numerical identifier for chemical substances.

Relevant articles and documents

Synthesis of the tricyclic core of solanoeclepin A through intramolecular [2+2] photocycloaddition of an allene butenolide

Studies are reported towards the synthesis of solanoeclepin A (1), the hatching agent of potato cyst nematodes. Two approaches are investigated to access the tricyclic core including the intricate bicyclo[2.1.1]hexanone moiety. The first approach is based on the intramolecular [2+2] photocycloaddition of dioxenone butenolide 10 and is shown to be less practical due to the limited synthetic utility of the photoproduct 11. The second approach uses as the key step the intramolecular [2+2] photocycloaddition reaction of allene butenolide 39. This latter photosubstrate is prepared through silver-mediated coupling of silyloxyfuran 9 and allenic bromide 34. A five-step sequence starting with the Baylis-Hillman reaction between benzyl butadienolate and paraformaldehyde leads to bromide 34. The crucial photocycloaddition of 39 proceeds with excellent regioselectivity and produces the adduct 40 in good yield. This methylenecyclobutane-containing product 40 is deemed to contain the appropriate functionalities for future studies towards the natural product as is indicated through a model study leading to cyclobutanone 25. Wiley-VCH Verlag GmbH & Co. KGaA, 2006.

Synthesis of the cyclobutanone core of solanoeclepin A intramolecular allene butenolide photocycloaddition.

The compact tricyclic substructure of solanoeclepin A containing the cyclobutanone ring was prepared by using as the key step a highly regioselective intramolecular [2 + 2]-photocycloaddition reaction between one of the [small pi]-bonds of an allene and t