6-Amino-4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol

Base Information

• Chemical Name: 6-Amino-4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol
• CAS No.: 6600-94-8
• Molecular Formula: C₈H₁₂N₂O₃*ClH
• Molecular Weight: 220.656
• DSSTox Substance ID: DTXSID40331380
• Nikkaji Number: J1.928.667C
• Wikidata: Q82096547
• Mol file: 6600-94-8.mol

Synonyms:6600-94-8;6-amino-4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;DTXSID40331380;3,4-Pyridinedimethanol,2-amino-5-hydroxy-6-methyl-,hydrochloride(1:1)

Chemical Property of 6-Amino-4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol

Chemical Property:

• Vapor Pressure: 6.05E-14mmHg at 25°C
• Boiling Point: 572.5°C at 760 mmHg
• Flash Point: 300°C
• PSA: 99.60000
• Density: 1.447g/cm³
• LogP: 1.04560
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 184.08479225
• Heavy Atom Count: 13
• Complexity: 168

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=C(C(=N1)N)CO)CO)O

Technology Process of 6-Amino-4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol

There total 2 articles about 6-Amino-4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol 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: 80.0%

6-phenylazopyridoxine hydrochloride → 6-aminopyridoxine hydrochloride (6600-94-8)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol; at 20 ℃; for 48h;

DOI:10.1021/ol0348147

Reference yield:

pyridoxal hydrochloride (58-56-0) → 6-aminopyridoxine hydrochloride (6600-94-8)

Guidance literature:

Multi-step reaction with 2 steps

1.1: hydrochloric acid; sodium nitrite / H₂O / 0 - 5 °C

1.2: 73 percent / sodium hydroxide / H₂O / 0 - 20 °C / pH 8

2.1: 80 percent / hydrogen / palladium on activated carbon / ethanol / 48 h / 20 °C

With hydrogenchloride; hydrogen; sodium nitrite; palladium on activated charcoal; In ethanol; water;

DOI:10.1021/ol0348147

upstream raw materials:

pyridoxal hydrochloride

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