(1-Benzyl-2-sulfanyl-1h-imidazol-5-yl)methanol

Base Information

• Chemical Name: (1-Benzyl-2-sulfanyl-1h-imidazol-5-yl)methanol
• CAS No.: 98412-23-8
• Molecular Formula: C11H12N2OS
• Molecular Weight: 220.295
• Hs Code.: 2933290090
• DSSTox Substance ID: DTXSID50381513
• Nikkaji Number: J1.792.912G
• Wikidata: Q82172386
• Mol file: 98412-23-8.mol

Synonyms:5-hydroxymethyl-2-mercapto-1-benzylimidazole

Chemical Property of (1-Benzyl-2-sulfanyl-1h-imidazol-5-yl)methanol

Chemical Property:

• Vapor Pressure: 9.95E-07mmHg at 25°C
• Melting Point: 238 °C
• Refractive Index: 1.705
• Boiling Point: 388.4 °C at 760 mmHg
• Flash Point: 188.7 °C
• PSA: 76.85000
• Density: 1.34 g/cm³
• LogP: 1.71240
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 220.06703418
• Heavy Atom Count: 15
• Complexity: 272

Purity/Quality:

99%, ^*data from raw suppliers

(1-benzyl-2-sulfanyl-1H-imidazol-5-yl)methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C(=CNC2=S)CO

Technology Process of (1-Benzyl-2-sulfanyl-1h-imidazol-5-yl)methanol

There total 9 articles about (1-Benzyl-2-sulfanyl-1h-imidazol-5-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: 97.0%

1,3-dihydroxyacetone dimer (62147-49-3) + potassium sulphocyanide + benzylamine (100-46-9) → 1-benzyl-2-mercapto-5-hydroxymethyl-imidazole (98412-23-8)

Guidance literature:

With acetic acid; In butan-1-ol; for 50h; Ambient temperature;

DOI:10.1002/jhet.5570330456

Reference yield: 97.0%

1,3-dihydroxyacetone dimer (62147-49-3) + benzylamine hydrochloride (3287-99-8,39110-74-2,108321-65-9) + potassium thioacyanate (333-20-0) → 1-benzyl-2-mercapto-5-hydroxymethyl-imidazole (98412-23-8) + 4-benzyl-3a-methyl-3a,4,6,6a-tetrahydro-2H-imidazo[4,5-d][1,3]oxazole-2(3H),5-dithione

Guidance literature:

With acetic acid; In water; acetonitrile; at 55 ℃; for 18h; Further Variations:; Solvents; Product distribution;

DOI:10.1002/jhet.5570400206

Reference yield: 96.0%

1,3-dihydroxyacetone dimer (62147-49-3) + benzylamine hydrochloride (3287-99-8,39110-74-2,108321-65-9) + potassium thioacyanate (333-20-0) → 5-hydroxymethyl-1-phenylmethylimidazoline-2(3H)-thione (98412-23-8)

Guidance literature:

With acetic acid; In water; acetonitrile; at 60 ℃; for 16h;

DOI:10.1021/ol502845h

upstream raw materials:

1,3-dihydroxyacetone dimer

benzylamine

dihydroxyacetone

benzylamine hydrochloride

Downstream raw materials:

1-benzyl-5-hydroxymethylimidazole

5-hydroxymethyl-2-methylthio-1-phenylmethylimidazole

2-ethylthio-5-hydroxymethyl-1-phenylmethylimidazole

5-hydroxymethyl-1-phenylmethyl-2-phenylmethylthioimidazole

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 98412-23-8 (1-Benzyl-2-sulfanyl-1h-imidazol-5-yl)methanol

Send

Send

Metric Ton KG G Pound L ML

Send

Send