Description

7-(2,2-Diphenylvinyl)-4-(p-tolyl)-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indole (CAS No. 213670-22-5) is a high-purity organic compound with the molecular formula C₃₂H₂₉N. This complex polycyclic structure features a hexahydrocyclopenta[b]indole core substituted with a 2,2-diphenylethenyl group at the 7-position and a p-tolyl group at the 4-position. The compound’s unique architecture makes it valuable for advanced research in medicinal chemistry and materials science. Supplied as a solid with ≥95% purity (HPLC), it is ideal for pharmaceutical development, organic synthesis, and as a building block for novel heterocyclic systems. Proper storage at 2-8°C under inert atmosphere is recommended to maintain stability.

Properties

• CAS Number: 213670-22-5
• Complexity: 640
• IUPAC Name: 7-(2,2-diphenylvinyl)-4-(p-tolyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole
• InChI: InChI=1S/C32H29N/c1-23-15-18-27(19-16-23)33-31-14-8-13-28(31)30-22-24(17-20-32(30)33)21-29(25-9-4-2-5-10-25)26-11-6-3-7-12-26/h2-7,9-12,15-22,28,31H,8,13-14H2,1H3
• InChI Key: QZEOZXJABDDEGH-UHFFFAOYSA-N
• Exact Mass: 427.229999929
• Molecular Formula: C32H29N
• Molecular Weight: 427.6
• SMILES: CC1=CC=C(C=C1)N2C3CCCC3C4=C2C=CC(=C4)C=C(C5=CC=CC=C5)C6=CC=CC=C6
• Topological: 3.2
• Monoisotopic Mass: 427.229999929
• Synonyms: 213670-22-5, 7-(2,2-Diphenylvinyl)-4-(p-tolyl)-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indole, 7-(2,2-Diphenylvinyl)-4-p-tolyl-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indole, 7-(2,2-diphenylethenyl)-4-(4-methylphenyl)-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]indole, 7-(2,2-Diphenylvinyl)-1,2,3,3a,4,8b-hexahydro-4-(4-methylphenyl)-cyclopent[b]indole, 7-(2,2-Diphenylethenyl)-1,2,3,3a,4,8b-hexahydro-4-(4-methylphenyl)-cyclopent[b]indole, QZEOZXJABDDEGH-UHFFFAOYSA-N, SCHEMBL10057480, DTXSID30657965, AKOS015840548, 7-(2,2-Diphenylethenyl)-4-(4-methylphenyl)-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indole

Application

This compound serves as a key intermediate in the synthesis of complex polycyclic systems with potential pharmacological activity. Researchers utilize it in the development of novel indole-based therapeutics targeting CNS disorders. Its extended conjugated system makes it of interest for optoelectronic materials research. The compound’s rigid structure is valuable for studying molecular recognition in host-guest chemistry.

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