4-(3-Pyrroline-1-yl)benzoic acid methyl ester

Base Information

Chemical Name:4-(3-Pyrroline-1-yl)benzoic acid methyl ester
CAS No.:134031-03-1
Molecular Formula:C₁₂H₁₃NO₂
Molecular Weight:203.241
Hs Code.:
DSSTox Substance ID:DTXSID001250474
Nikkaji Number:J1.145.628F

Synonyms:134031-03-1;DTXSID001250474;4-(3-Pyrroline-1-yl)benzoic acid methyl ester;Methyl 4-(2,5-dihydro-1H-pyrrol-1-yl)benzoate

Suppliers and Price of 4-(3-Pyrroline-1-yl)benzoic acid 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
Packaging
price

Total 0 raw suppliers

Chemical Property of 4-(3-Pyrroline-1-yl)benzoic acid methyl ester

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:203.094628657
Heavy Atom Count:15
Complexity:246

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C1=CC=C(C=C1)N2CC=CC2

Technology Process of 4-(3-Pyrroline-1-yl)benzoic acid methyl ester

There total 2 articles about 4-(3-Pyrroline-1-yl)benzoic acid 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: 83.0%

: 1476-11-5
Z-1,4-dichlorobutene

: 619-45-4
4-methoxycarbonyl aniline

: 134031-03-1
N-<4'-(methoxycarbonyl)phenyl>-3-pyrroline

Guidance literature:: With sodium acetate; potassium iodide; In methanol; for 5h; Heating;
DOI:10.1021/jo00018a045

Reference yield: 83.0%

: 241821-37-4
4-diallylamino-benzoic acid methyl ester

: 134031-03-1
N-<4'-(methoxycarbonyl)phenyl>-3-pyrroline

Guidance literature:: With Grubbs catalyst first generation; In dichloromethane; at 20 ℃;
DOI:10.1016/S0040-4039(99)00993-4

Reference yield:

: 134031-03-1
N-<4'-(methoxycarbonyl)phenyl>-3-pyrroline

: 90030-20-9
N-<4'-(methoxycarbonyl)phenyl>-3-pyrrolidinone

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) BH₃*THF, 2.) 3 N NaOH, 30percent H₂O₂ / 1.) THF, room temperature, 1 h, 2.) H₂O, room temperature, 1 h

2: 61 percent / DMSO, dicyclohexylcarbodiimide, pyridine / CF₃COOH / benzene / 48.5 h / Ambient temperature

With pyridine; sodium hydroxide; borane-THF; dihydrogen peroxide; dimethyl sulfoxide; dicyclohexyl-carbodiimide; trifluoroacetic acid; In benzene;
DOI:10.1021/jo00018a045