Benzoic acid (5S,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-1,3-dioxo-2-phenyl-2,3,5,6,7,8,9,10-octahydro-1H-[1,2,4]triazolo[1,2-b]phthalazin-7-yl ester

Base Information

• Chemical Name: Benzoic acid (5S,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-1,3-dioxo-2-phenyl-2,3,5,6,7,8,9,10-octahydro-1H-[1,2,4]triazolo[1,2-b]phthalazin-7-yl ester
• CAS No.: 82890-32-2
• Molecular Formula: C₄₂H₅₃N₃O₄
• Molecular Weight: 663.901

Synonyms:

Chemical Property of Benzoic acid (5S,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-1,3-dioxo-2-phenyl-2,3,5,6,7,8,9,10-octahydro-1H-[1,2,4]triazolo[1,2-b]phthalazin-7-yl ester

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of Benzoic acid (5S,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-1,3-dioxo-2-phenyl-2,3,5,6,7,8,9,10-octahydro-1H-[1,2,4]triazolo[1,2-b]phthalazin-7-yl ester

There total 2 articles about Benzoic acid (5S,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-1,3-dioxo-2-phenyl-2,3,5,6,7,8,9,10-octahydro-1H-[1,2,4]triazolo[1,2-b]phthalazin-7-yl ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

benzoyl chloride (98-88-4) + (5R,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-Dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-7-hydroxy-2-phenyl-5,6,7,8,9,10-hexahydro-[1,2,4]triazolo[1,2-b]phthalazine-1,3-dione (67529-54-8) → Benzoic acid (5R,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-1,3-dioxo-2-phenyl-2,3,5,6,7,8,9,10-octahydro-1H-[1,2,4]triazolo[1,2-b]phthalazin-7-yl ester (82858-66-0,82890-32-2)

Guidance literature:

With pyridine; In diethyl ether;

DOI:10.1007/BF00799919

Reference yield:

benzoyl chloride (98-88-4) + (5S,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-Dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-7-hydroxy-2-phenyl-5,6,7,8,9,10-hexahydro-[1,2,4]triazolo[1,2-b]phthalazine-1,3-dione (67529-55-9) → Benzoic acid (5S,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-1,3-dioxo-2-phenyl-2,3,5,6,7,8,9,10-octahydro-1H-[1,2,4]triazolo[1,2-b]phthalazin-7-yl ester (82858-66-0,82890-32-2)

Guidance literature:

With pyridine; In diethyl ether;

DOI:10.1007/BF00799919

Reference yield: 74.0%

Benzoic acid (5R,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-1,3-dioxo-2-phenyl-2,3,5,6,7,8,9,10-octahydro-1H-[1,2,4]triazolo[1,2-b]phthalazin-7-yl ester (82858-66-0,82890-32-2) → C42H53N3O5 (82858-67-1,82890-33-3)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; In chloroform; for 96h; Ambient temperature;

DOI:10.1007/BF00799919

upstream raw materials:

benzoyl chloride

(5R,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-Dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-7-hydroxy-2-phenyl-5,6,7,8,9,10-hexahydro-[1,2,4]triazolo[1,2-b]phthalazine-1,3-dione

(5S,7S)-5-[(1R,3aS,7aR)-1-((R)-1,5-Dimethyl-hexyl)-7a-methyl-octahydro-inden-(4E)-ylidenemethyl]-7-hydroxy-2-phenyl-5,6,7,8,9,10-hexahydro-[1,2,4]triazolo[1,2-b]phthalazine-1,3-dione

Downstream raw materials:

C₄₂H₅₃N₃O₅

(5S,7S)-5-{(S)-[(1R,7aR)-1-((R)-1,5-Dimethyl-hexyl)-7a-methyl-2,3,5,6,7,7a-hexahydro-1H-inden-4-yl]-hydroxy-methyl}-7-hydroxy-2-phenyl-5,6,7,8,9,10-hexahydro-[1,2,4]triazolo[1,2-b]phthalazine-1,3-dione

C₃₅H₄₉N₃O₄

C₄₂H₅₃N₃O₅

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