Benzo(6,7)cyclohepta(1,2-c)pyrazole, 2,3,3a,4,5,6-hexahydro-2-acetyl-8-methoxy-3-phenyl-, cis-

Base Information Edit

Chemical Name:Benzo(6,7)cyclohepta(1,2-c)pyrazole, 2,3,3a,4,5,6-hexahydro-2-acetyl-8-methoxy-3-phenyl-, cis-
CAS No.:78431-43-3
Molecular Formula:C₂₁H₂₂N₂O₂
Molecular Weight:334.418
Hs Code.:
DSSTox Substance ID:DTXSID40229076
Wikidata:Q83109260
Mol file:78431-43-3.mol

Synonyms:cis-2,3,3a,4,5,6-Hexahydro-2-acetyl-8-methoxy-3-phenylbenzo(6,7)cyclohepta(1,2-c)pyrazole;Benzo(6,7)cyclohepta(1,2-c)pyrazole, 2,3,3a,4,5,6-hexahydro-2-acetyl-8-methoxy-3-phenyl-, cis-;78431-43-3;DTXSID40229076;LS-33745

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Benzo(6,7)cyclohepta(1,2-c)pyrazole, 2,3,3a,4,5,6-hexahydro-2-acetyl-8-methoxy-3-phenyl-, cis- Edit

Chemical Property:

Vapor Pressure:2.55E-10mmHg at 25°C
Boiling Point:504.9°Cat760mmHg
Flash Point:259.2°C
Density:1.22g/cm³
XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:334.168127949
Heavy Atom Count:25
Complexity:526

Purity/Quality:

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MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)N1C(C2CCCC3=C(C2=N1)C=CC(=C3)OC)C4=CC=CC=C4
Isomeric SMILES:CC(=O)N1[C@@H]([C@H]2CCCC3=C(C2=N1)C=CC(=C3)OC)C4=CC=CC=C4

Technology Process of Benzo(6,7)cyclohepta(1,2-c)pyrazole, 2,3,3a,4,5,6-hexahydro-2-acetyl-8-methoxy-3-phenyl-, cis-

There total 2 articles about Benzo(6,7)cyclohepta(1,2-c)pyrazole, 2,3,3a,4,5,6-hexahydro-2-acetyl-8-methoxy-3-phenyl-, cis- 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: