(3-(Benzyloxy)-5-(benzyloxymethyl)-2-methyl-pyridin-4-yl)methanol

Base Information

• Chemical Name: (3-(Benzyloxy)-5-(benzyloxymethyl)-2-methyl-pyridin-4-yl)methanol
• CAS No.: 25183-10-2
• Molecular Formula: C22H23 N O3
• Molecular Weight: 349.4229
• NSC Number: 107527
• DSSTox Substance ID: DTXSID00296082
• Wikidata: Q82036424
• ChEMBL ID: CHEMBL493093
• Mol file: 25183-10-2.mol

Synonyms:MLS002703986;25183-10-2;(3-(benzyloxy)-5-(benzyloxymethyl)-2-methyl-pyridin-4-yl)methanol;NSC107527;CHEMBL493093;DTXSID00296082;NCI-107527;NSC-107527;SMR001570695

Chemical Property of (3-(Benzyloxy)-5-(benzyloxymethyl)-2-methyl-pyridin-4-yl)methanol

Chemical Property:

• Vapor Pressure: 3.4E-11mmHg at 25°C
• Boiling Point: 509.3°C at 760 mmHg
• Flash Point: 261.8°C
• PSA: 51.58000
• Density: 1.175g/cm³
• LogP: 4.17810
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 349.16779360
• Heavy Atom Count: 26
• Complexity: 380

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=NC=C(C(=C1OCC2=CC=CC=C2)CO)COCC3=CC=CC=C3

Technology Process of (3-(Benzyloxy)-5-(benzyloxymethyl)-2-methyl-pyridin-4-yl)methanol

There total 5 articles about (3-(Benzyloxy)-5-(benzyloxymethyl)-2-methyl-pyridin-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: 83.0%

5'-O-benzylpyridoxine (26864-21-1) + benzyldimethylphenylammonium chloride (3204-68-0) → 3,5'-O-dibenzylpyridoxine (25183-10-2)

Guidance literature:

With sodium methylate; In methanol; for 0.333333h; Ambient temperature;

DOI:10.1021/jo00008a071

Reference yield:

5-hydroxy-6-methyl-3,4-pyridinedimethanol (65-23-6) → 3,5'-O-dibenzylpyridoxine (25183-10-2)

Guidance literature:

Multi-step reaction with 4 steps

1: 83 percent / p-TsOH / acetone / 16 h

2: 1) NaH / 1) THF, 30 min, reflux, 2) 4 h, reflux

3: 94 percent / 98percent formic acid / H₂O / 24 h / 50 °C

4: 83 percent / NaOMe / methanol / 0.33 h / Ambient temperature

With formic acid; sodium methylate; sodium hydride; toluene-4-sulfonic acid; In methanol; water; acetone;

DOI:10.1021/jo00008a071

Reference yield:

3,4'-O-isopropylidene-5'-O-benzylpyridoxine (26864-20-0) → 3,5'-O-dibenzylpyridoxine (25183-10-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 94 percent / 98percent formic acid / H₂O / 24 h / 50 °C

2: 83 percent / NaOMe / methanol / 0.33 h / Ambient temperature

With formic acid; sodium methylate; In methanol; water;

DOI:10.1021/jo00008a071

upstream raw materials:

5'-O-benzylpyridoxine

benzyldimethylphenylammonium chloride

(2,2,8-trimethyl-4H-[1,3]dioxino[4,5-c]pyridin-5-yl)methanol

5-hydroxy-6-methyl-3,4-pyridinedimethanol

Downstream raw materials:

3,5'-O-dibenzylpyridoxal

C₂₂H₂₁⁽³⁾HN₄O₂

C₂₂H₂₁⁽³⁾HN₄O₂

C₂₂H₂₂⁽³⁾HNO₃