3-Isoquinolinecarboxylic acid, 4-phenyl-1-(1-pyrrolidinyl)-, methyl ester

Base Information

Chemical Name:3-Isoquinolinecarboxylic acid, 4-phenyl-1-(1-pyrrolidinyl)-, methyl ester
CAS No.:78945-93-4
Molecular Formula:C₂₁H₂₀N₂O₂
Molecular Weight:332.402
Hs Code.:
DSSTox Substance ID:DTXSID40229399

Synonyms:78945-93-4;3-Isoquinolinecarboxylic acid, 4-phenyl-1-(1-pyrrolidinyl)-, methyl ester;Methyl 4-phenyl-1-(1-pyrrolidinyl)-3-isoquinolinecarboxylate;4-phenyl-1-(1-pyrrolidinyl)-3-isoquinolinecarboxylic acid methyl ester;DTXSID40229399;LS-85454

Suppliers and Price of 3-Isoquinolinecarboxylic acid, 4-phenyl-1-(1-pyrrolidinyl)-, methyl ester

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of 3-Isoquinolinecarboxylic acid, 4-phenyl-1-(1-pyrrolidinyl)-, methyl ester

Chemical Property:

Vapor Pressure:1.39E-12mmHg at 25°C
Boiling Point:560.3°Cat760mmHg
Flash Point:292.7°C
Density:1.211g/cm³
XLogP3:4.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:332.152477885
Heavy Atom Count:25
Complexity:457

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=C(C2=CC=CC=C2C(=N1)N3CCCC3)C4=CC=CC=C4

Technology Process of 3-Isoquinolinecarboxylic acid, 4-phenyl-1-(1-pyrrolidinyl)-, methyl ester

There total 2 articles about 3-Isoquinolinecarboxylic acid, 4-phenyl-1-(1-pyrrolidinyl)-, methyl 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:

: 69454-47-3
3-carbossimetil-4-fenil-1,2-diidro-1-ossiisochinolina

: 78945-93-4
1-pyrrolidino-3-carboxymethyl-4-phenylisoquinoline

Guidance literature:: Multi-step reaction with 2 steps

1: 92 percent / POCl₃, PCl₅ / 3 h / 140 °C

2: 91 percent / 2.5 h / 100 °C

With phosphorus pentachloride; trichlorophosphate;

Reference yield:

: 78945-99-0
1-oxo-4-phenyl-1,2-dihydroisoquinoline-3-carboxylic acid

: 78945-93-4
1-pyrrolidino-3-carboxymethyl-4-phenylisoquinoline

Guidance literature:: Multi-step reaction with 3 steps

1: 81 percent / 10percent H₂SO₄ / 10 h / Heating

2: 92 percent / POCl₃, PCl₅ / 3 h / 140 °C

3: 91 percent / 2.5 h / 100 °C

With phosphorus pentachloride; sulfuric acid; trichlorophosphate;