(3-Methylpyridin-4-yl)methanol

Base Information

• Chemical Name: (3-Methylpyridin-4-yl)methanol
• CAS No.: 38070-73-4
• Molecular Formula: C₇H₉NO
• Molecular Weight: 123.155
• Hs Code.: 2933399090
• European Community (EC) Number: 889-943-4
• DSSTox Substance ID: DTXSID20363801
• Nikkaji Number: J2.508.456J
• Wikidata: Q82147534
• Mol file: 38070-73-4.mol

Synonyms:(3-methylpyridin-4-yl)methanol;38070-73-4;4-Hydroxymethyl-3-methylpyridine;4-Pyridinemethanol, 3-methyl-;(3-methyl-pyridin-4-yl)-methanol;(3-methyl-4-pyridyl)methanol;SCHEMBL1448227;3-methyl-4-hydroxymethylpyridine;DTXSID20363801;3-METHYLPYRIDINE-4-METHANOL;4-(Hydroxymethyl)-3-methylpyridine;MFCD04038635;AKOS006294891;PB32359;AS-34292;AM20051127;CS-0053354;FT-0727650;EN300-1653554;A824001;J-501226;Z1198163942

Chemical Property of (3-Methylpyridin-4-yl)methanol

Chemical Property:

• Vapor Pressure: 0.00552mmHg at 25°C
• Refractive Index: 1.544
• Boiling Point: 262.4°Cat760mmHg
• Flash Point: 112.5°C
• PSA: 33.12000
• Density: 1.092g/cm³
• LogP: 0.88230
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 123.068413911
• Heavy Atom Count: 9
• Complexity: 85

Purity/Quality:

99%, ^*data from raw suppliers

(3-Methylpyridin-4-yl)methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CN=C1)CO

Technology Process of (3-Methylpyridin-4-yl)methanol

There total 5 articles about (3-Methylpyridin-4-yl)methanol 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: 100.0%

3-methyl-isonicotinic acid (4021-12-9) → 4-hydroxymethyl-3-methylpyridine (38070-73-4)

Guidance literature:

With borane-THF; In tetrahydrofuran; at 0 - 20 ℃; for 16h;

DOI:10.1021/jacs.7b12768

Reference yield: 85.0%

Methyl 3-methylpyridine-4-carboxylate (116985-92-3) → 4-hydroxymethyl-3-methylpyridine (38070-73-4)

Guidance literature:

With methanol; sodium tetrahydroborate; at 0 - 60 ℃; Inert atmosphere;

Reference yield: 49.0%

3,4-Lutidin (583-58-4) → 4-hydroxymethyl-3-methylpyridine (38070-73-4)

Guidance literature:

3,4-Lutidin; With n-butyllithium; In tetrahydrofuran; hexane; at -78 - 20 ℃; for 1.91667h;

With oxygen; In tetrahydrofuran; hexane; at -78 - 20 ℃; for 2h;

With dimethylsulfide; triethylamine; In tetrahydrofuran; hexane; at 20 ℃; for 20h; Further stages.;

DOI:10.1055/s-2007-983817

upstream raw materials:

3,4-Lutidin

3-methylisonicotinic acid ethyl ester

3-methyl-isonicotinic acid

Methyl 3-methylpyridine-4-carboxylate

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