5-O-methyl 1-O-phenyl 3,6-dihydro-2H-pyridine-1,5-dicarboxylate

Base Information

Chemical Name:5-O-methyl 1-O-phenyl 3,6-dihydro-2H-pyridine-1,5-dicarboxylate
CAS No.:323201-17-8
Molecular Formula:C14H15 N O4
Molecular Weight:261.277
Hs Code.:
DSSTox Substance ID:DTXSID50363738
Nikkaji Number:J1.620.087E
Wikidata:Q82147477
Mol file:323201-17-8.mol

Synonyms:323201-17-8;5-O-methyl 1-O-phenyl 3,6-dihydro-2H-pyridine-1,5-dicarboxylate;SCHEMBL7678364;DTXSID50363738;3-methyl 1-phenyl 5,6-dihydropyridine-1,3(2H)-dicarboxylate;FT-0765850;1,2,5,6-Tetrahydropyridine-1,3-dicarboxylic acid 1-phenyl 3-methyl ester;5,6-dihydro-1,3(2h)-pyridinedicarboxylic acid 3-methyl 1-phenyl ester;5,6-Dihydro-1,3(2H)-pyridinedicarboxylic acid,3-methyl 1-phenyl ester

Suppliers and Price of 5-O-methyl 1-O-phenyl 3,6-dihydro-2H-pyridine-1,5-dicarboxylate

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

American Custom Chemicals Corporation
5,6-DIHYDRO-1,3(2H)-PYRIDINEDICARBOXYLIC ACID, 3-METHYL 1-PHENYL ESTER 95.00%
2G
$ 2425.50

Total 1 raw suppliers

Chemical Property of 5-O-methyl 1-O-phenyl 3,6-dihydro-2H-pyridine-1,5-dicarboxylate

Chemical Property:

Boiling Point:379.4±42.0 °C(Predicted)
PKA:-2.98±0.40(Predicted)
PSA：55.84000
Density:1.246±0.06 g/cm3(Predicted)
LogP:1.92840
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:261.10010796
Heavy Atom Count:19
Complexity:372

Purity/Quality:: 5,6-DIHYDRO-1,3(2H)-PYRIDINEDICARBOXYLIC ACID, 3-METHYL 1-PHENYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=CCCN(C1)C(=O)OC2=CC=CC=C2

Technology Process of 5-O-methyl 1-O-phenyl 3,6-dihydro-2H-pyridine-1,5-dicarboxylate

There total 4 articles about 5-O-methyl 1-O-phenyl 3,6-dihydro-2H-pyridine-1,5-dicarboxylate 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: 99.0%

: 323201-15-6
2H-pyridine-1,3-dicarboxylic acid 3-methyl ester 1-phenyl ester

: 323201-17-8
3-methoxycarbonyl-1-phenoxycarbonyl-1,2,5,6-tetrahydropyridine

Guidance literature:: With sodium tetrahydroborate; trifluoroacetic acid; In benzene; at 5 ℃;
DOI:10.1021/ol006810x

Reference yield: 76.0%

: 300-08-3
arecoline hydrobromide

: 1885-14-9
phenyl chloroformate

: 323201-17-8
3-methoxycarbonyl-1-phenoxycarbonyl-1,2,5,6-tetrahydropyridine

Guidance literature:: arecoline hydrobromide; With sodium hydrogencarbonate;

phenyl chloroformate; In dichloromethane; at 0 - 20 ℃; for 24h;
DOI:10.1590/S0103-50532010000500009

Reference yield:

: 93-60-7
methyl 3-pyridinecarboxylate

: 323201-17-8
3-methoxycarbonyl-1-phenoxycarbonyl-1,2,5,6-tetrahydropyridine

Guidance literature:: Multi-step reaction with 2 steps

1: 97 percent / sodium borohydride / methanol / 3 h / -78 °C

2: 99 percent / NaBH₄-TFA / benzene / 5 °C

With sodium tetrahydroborate; trifluoroacetic acid; In methanol; benzene; 1: Fowler reduction;
DOI:10.1021/ol006810x