Methyl 5-(m-tolyl)nicotinate

Base Information

Chemical Name:Methyl 5-(m-tolyl)nicotinate
CAS No.:93349-93-0
Molecular Formula:C14H13NO2
Molecular Weight:227.25900
Hs Code.:2933399090
DSSTox Substance ID:DTXSID90602431
Wikidata:Q82499500
Mol file:93349-93-0.mol

Synonyms:Methyl 5-(m-tolyl)nicotinate;93349-93-0;Methyl 5-(3-methylphenyl)nicotinate;Methyl 5-(3-methylphenyl)pyridine-3-carboxylate;methyl 5-m-tolylpyridine-3-carboxylate;Methyl5-(m-tolyl)nicotinate;SCHEMBL10093458;DTXSID90602431;AKOS004116052;DB-265485

Suppliers and Price of Methyl 5-(m-tolyl)nicotinate

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
METHYL-5-(META-TOLYL)NICOTINATE 95.00%
5MG
$ 505.00

Total 6 raw suppliers

Chemical Property of Methyl 5-(m-tolyl)nicotinate

Chemical Property:

Boiling Point:362.0±30.0 °C(Predicted)
PKA:2.88±0.21(Predicted)
PSA：39.19000
Density:1.124±0.06 g/cm3(Predicted)
LogP:2.84360
Storage Temp.:2-8°C
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:227.094628657
Heavy Atom Count:17
Complexity:267

Purity/Quality:

95+% ^*data from raw suppliers

METHYL-5-(META-TOLYL)NICOTINATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=CC=C1)C2=CC(=CN=C2)C(=O)OC

Technology Process of Methyl 5-(m-tolyl)nicotinate

There total 3 articles about Methyl 5-(m-tolyl)nicotinate 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:

: 59-67-6
nicotinic acid

: 93349-93-0
Methyl 5-(3-Methylphenyl)nicotinate

Guidance literature:: Multi-step reaction with 4 steps

1: SOCl₂ / neat (no solvent) / 24 h / Heating

2: bromine / 1 h / 150 °C

3: CH₂Cl₂ / 1. ice bath 2. 30 min reflux

4: 98 percent / NEt₃ / Pd(OAc)2, PPh₃ / dimethylformamide / 3 h / 100 °C

With thionyl chloride; bromine; triethylamine; palladium diacetate; triphenylphosphine; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jo00200a045

Reference yield:

: 10400-19-8
3-pyridinecarbonyl chloride

: 93349-93-0
Methyl 5-(3-Methylphenyl)nicotinate

Guidance literature:: Multi-step reaction with 3 steps

1: bromine / 1 h / 150 °C

2: CH₂Cl₂ / 1. ice bath 2. 30 min reflux

3: 98 percent / NEt₃ / Pd(OAc)2, PPh₃ / dimethylformamide / 3 h / 100 °C

With bromine; triethylamine; palladium diacetate; triphenylphosphine; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jo00200a045

Reference yield:

: 39620-02-5
5-bromonicotinoyl chloride

: 93349-93-0
Methyl 5-(3-Methylphenyl)nicotinate

Guidance literature:: Multi-step reaction with 2 steps

1: CH₂Cl₂ / 1. ice bath 2. 30 min reflux

2: 98 percent / NEt₃ / Pd(OAc)2, PPh₃ / dimethylformamide / 3 h / 100 °C

With triethylamine; palladium diacetate; triphenylphosphine; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jo00200a045