4-Pyridinemethanol

Base Information

• Chemical Name: 4-Pyridinemethanol
• CAS No.: 586-95-8
• Molecular Formula: C6H7NO
• Molecular Weight: 109.128
• Hs Code.: 29333999
• European Community (EC) Number: 209-590-6
• NSC Number: 49167,26024
• DSSTox Substance ID: DTXSID90870638
• Nikkaji Number: J85.689D
• Wikidata: Q27464630
• ChEMBL ID: CHEMBL1235528
• Mol file: 586-95-8.mol

Synonyms:4-hydroxymethylpyridine

Chemical Property of 4-Pyridinemethanol

Chemical Property:

• Appearance/Colour: white to yellow crystals, crystalline powder
• Vapor Pressure: 0.00134mmHg at 25°C
• Melting Point: 52-56 °C(lit.)
• Refractive Index: 1.551
• Boiling Point: 285.1 °C at 760 mmHg
• PKA: 13.45±0.10(Predicted)
• Flash Point: 98.9 °C
• PSA: 33.12000
• Density: 1.131 g/cm³
• LogP: 0.57390
• Storage Temp.: 2-8°C
• Sensitive.: Hygroscopic
• Water Solubility.: soluble
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 109.052763847
• Heavy Atom Count: 8
• Complexity: 59.5

Purity/Quality:

99% ^*data from raw suppliers

4-Pyridinemethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-22
• Safety Statements: 26-36-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CN=CC=C1CO
• Uses: 4-Pyridinemethanol was used in the preparation of 4-pyridine carboxaldehyde.

Technology Process of 4-Pyridinemethanol

There total 49 articles about 4-Pyridinemethanol 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%

pyridine-4-carbaldehyde (872-85-5) → pyridine-4-methanol (586-95-8)

Guidance literature:

With magnesium(II) perchlorate; polymer-bound NADH (2a); In acetonitrile; benzene; at 80 ℃; for 120h; Further byproducts given;

DOI:10.1016/S0040-4039(00)85780-9

Reference yield: 98.0%

4-pyridinecarboxylic acid, methyl ester (2459-09-8) → pyridine-4-methanol (586-95-8)

Guidance literature:

With sodium tetrahydroborate; sodium methylate; In methanol; at 25 ℃; for 3h; Inert atmosphere;

DOI:10.1021/acs.joc.7b02993

Reference yield: 91.0%

pyridine-4-carbaldehyde (872-85-5) → pyridine-4-methanol (586-95-8) + pyridine-4-carboxylic acid (55-22-1)

Guidance literature:

With sodium hydroxide; In water; at 25 ℃; for 4h;

DOI:10.1039/c5nj02313k

upstream raw materials:

4-(aminomethyl)pyridine

pyridine-4-carboxylic acid

(2,6-dichloropyridin-4-yl)methanol

isonicotinic acid ethylester

Downstream raw materials:

2-[2-(4-fluorophenyl)-6-oxo-5-(pyridin-4-ylmethoxycarbonylamino)-1,6-dihydro-1-pyrimidinyl]-N-(2-tert-butyldimethylsilyloxy-3,3,3-trifluoro-1-isopropylpropyl)acetamide

pyridine-4-carbaldehyde

isonicotinate tert-butyl ester

4-acetoxymethylpyridine

Refernces

• 1、 Relitti, Nicola,Saraswati, A. Prasanth,Chemi, Giulia,Brindisi, Margherita,Brogi, Simone,Herp, Daniel,Schmidtkunz, Karin,Saccoccia, Fulvio,Ruberti, Giovina,Ulivieri, Cristina,Vanni, Francesca,Sarno, Federica,Altucci, Lucia,Lamponi, Stefania,Jung, Manfred,Gemma, Sandra,Butini, Stefania,Campiani, Giuseppe. "Novel quinolone-based potent and selective HDAC6 inhibitors: Synthesis, molecular modeling studies and biological investigation". . . Retrieved 2020/11/24.
• 2、 Hori, Momoko,Ishikawa, Ryuta,Koga, Yuji,Matsubara, Kouki,Mitsuyama, Tomoaki,Shin, Sayaka. "Homoleptic cobalt(II) phenoxyimine complexes for hydrosilylation of aldehydes and ketones without base activation of cobalt(II)". . p. 1379 - 1387. Retrieved 2021/05/29.