Ethyl 6-methylpyridine-2-carboxylate

Base Information

• Chemical Name: Ethyl 6-methylpyridine-2-carboxylate
• CAS No.: 39640-51-2
• Molecular Formula: C9H11 N O2
• Molecular Weight: 165.192
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID30340421
• Nikkaji Number: J1.413.267H
• Wikidata: Q82110052
• Mol file: 39640-51-2.mol

Synonyms:Ethyl 6-methylpyridine-2-carboxylate;39640-51-2;ethyl 6-methylpicolinate;Ethyl 6-methyl-2-pyridinecarboxylate;6-Methylpyridine-2-carboxylic acid ethyl ester;ethyl-6-methylpyridinecarboxylate;6-Methyl-pyridine-2-carboxylic acid ethyl ester;SCHEMBL109583;DTXSID30340421;ethyl 6-methyl-2-pyridylcarboxylate;MFCD03427128;AKOS005157109;SB53881;Ethyl 6-methyl-2-pyridinecarboxylate #;6-Methylpyridine-2-carboxylicacidethylester;Ethyl 6-methylpyridine-2-carboxylate, 97%;CS-0327462;4-(CYANOMETHYL)PHENYL2-CHLORONICOTINATE;D84508;ETHYL 6-METHYL-2-PYRIDINECARBOXYLATE 9&

Chemical Property of Ethyl 6-methylpyridine-2-carboxylate

Chemical Property:

• Vapor Pressure: 0.0135mmHg at 25°C
• Refractive Index: n20/D 1.5090(lit.)
• Boiling Point: 122-126oC/10 mmHg(lit.)
• PKA: 2.06±0.10(Predicted)
• Flash Point: 110.3oC
• PSA: 39.19000
• Density: 1.083 g/mL at 25oC(lit.)
• LogP: 1.56670
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 165.078978594
• Heavy Atom Count: 12
• Complexity: 159

Purity/Quality:

Ethyl 6-methylpyridine-2-carboxylate 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=CC(=N1)C

Technology Process of Ethyl 6-methylpyridine-2-carboxylate

There total 5 articles about Ethyl 6-methylpyridine-2-carboxylate 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: 78.0%

6-methyl-2-pyridinecarboxylic acid (934-60-1) + ethanol (64-17-5) → ethyl 6-methylpyridine-2-carboxylate (39640-51-2)

Guidance literature:

With sulfuric acid; for 22h; Reflux;

Reference yield: 76.13%

→ ethyl 6-methylpyridine-2-carboxylate (39640-51-2)

Guidance literature:

Reference yield:

6-(hydroxymethyl)pyridine-2-carboxylic acid (1197-10-0) → 6-methyl-piperidine-2-carboxylic acid ethyl ester (20077-29-6) + ethyl 6-methylpyridine-2-carboxylate (39640-51-2) + ethyl 6-(hydroxymethyl)pyridine-2-carboxylate (41337-81-9) + 6-hydroxymethylpiperidine-2-carboxylic acid (287925-06-8,692255-19-9)

Guidance literature:

With hydrogenchloride; hydrogen; platinum(IV) oxide; In water; for 16h; under 760 Torr; Product distribution; also other pyridine esters; var. catalysts and conditions;

DOI:10.1002/jhet.5570310635

upstream raw materials:

6-methyl-2-pyridinecarboxylic acid

ethanol

6-(hydroxymethyl)pyridine-2-carboxylic acid

2,6-dimethylpyridine

Downstream raw materials:

2-methyl-6-(diphenylhydroxymethyl)pyridine

N-benzyl-6-methylpicolinamide

6-methyl-2-picolinic acid hydrazide

Ethyl 6-(4'-nitrostyryl)picolinate