Benzenemethanol, 3-(1H-imidazol-4-ylmethyl)-2-methyl-

Base Information

Chemical Name:Benzenemethanol, 3-(1H-imidazol-4-ylmethyl)-2-methyl-
CAS No.:115664-37-4
Molecular Formula:C₁₂H₁₄N₂O
Molecular Weight:202.256
Hs Code.:
DSSTox Substance ID:DTXSID80567303
Wikidata:Q82453148
Mol file:115664-37-4.mol

Synonyms:115664-37-4;[3-(1H-imidazol-5-ylmethyl)-2-methylphenyl]methanol;Benzenemethanol, 3-(1H-imidazol-4-ylmethyl)-2-methyl-;(3-((1H-Imidazol-4-yl)methyl)-2-methylphenyl)methanol;Benzenemethanol, 3-(1H-imidazol-5-ylmethyl)-2-methyl-;3-hydroxydetomidine;DTXSID80567303;CHEBI:167754;NS00096935;{3-[(1H-Imidazol-5-yl)methyl]-2-methylphenyl}methanol;3-(1H-Imidazol-5-ylmethyl)-2-methylbenzenemethanol Hydrochloride

Suppliers and Price of Benzenemethanol, 3-(1H-imidazol-4-ylmethyl)-2-methyl-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

AccelPharmtech
3-(1H-imidazol-5-ylmethyl)-2-methyl-Benzenemethanol 97.00%
25G
$ 13300.00

AccelPharmtech
3-(1H-imidazol-5-ylmethyl)-2-methyl-Benzenemethanol 97.00%
5G
$ 5360.00

AccelPharmtech
3-(1H-imidazol-5-ylmethyl)-2-methyl-Benzenemethanol 97.00%
1G
$ 3120.00

Total 6 raw suppliers

Chemical Property of Benzenemethanol, 3-(1H-imidazol-4-ylmethyl)-2-methyl-

Chemical Property:

Melting Point:202-205°C
Boiling Point:455.4±40.0 °C(Predicted)
PKA:14.40±0.10(Predicted)
PSA：48.91000
Density:1.186±0.06 g/cm3(Predicted)
LogP:2.60320
Storage Temp.:Hygroscopic, -20°C Freezer, Under Inert Atmosphere
Solubility.:Methanol (Slightly), Water (Slightly)
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:202.110613074
Heavy Atom Count:15
Complexity:198

Purity/Quality:

99.90% ^*data from raw suppliers

3-(1H-imidazol-5-ylmethyl)-2-methyl-Benzenemethanol 97.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=CC=C1CO)CC2=CN=CN2
Uses A metabolite of the sedative drug Detomidine.

Technology Process of Benzenemethanol, 3-(1H-imidazol-4-ylmethyl)-2-methyl-

There total 6 articles about Benzenemethanol, 3-(1H-imidazol-4-ylmethyl)-2-methyl- 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: 58.0%

: 146197-54-8
4-(3-methoxymethoxymethyl-2-methylbenzyl)-1-triphenylmethylimidazole

: 115664-37-4
3-(4⁽⁵⁾-imidazolylmethyl)-2-methylbenzyl alcohol

Guidance literature:: With hydrogenchloride; at 110 - 120 ℃; for 2.5h;

Reference yield:

: 133232-56-1
3-iodo-2-methylbenzoic acid

: 115664-37-4
3-(4⁽⁵⁾-imidazolylmethyl)-2-methylbenzyl alcohol

Guidance literature:: Multi-step reaction with 6 steps

1: 54 percent / trimethyl borate, BH₃*Me₂S / tetrahydrofuran / 1.5 h / Ambient temperature

2: 86 percent / LiBr, p-TsOH / Ambient temperature

3: 1.) Mg, 1,2-dibromoethane / 1.) THF, reflux, 6.5 h, 2.) THF, RT, overnight

4: 90 percent / MnO₂ / CHCl₃ / 1 h / Heating

5: 51 percent / KOH, hydrazine hydrate / ethane-1,2-diol / 2 h / 200 °C

6: 58 percent / aq. HCl / 2.5 h / 110 - 120 °C

With hydrogenchloride; manganese(IV) oxide; potassium hydroxide; Trimethyl borate; dimethylsulfide borane complex; toluene-4-sulfonic acid; hydrazine hydrate; magnesium; ethylene dibromide; lithium bromide; In tetrahydrofuran; chloroform; ethylene glycol;

Reference yield:

: 76350-89-5
(3-iodo-2-methylphenyl)methanol

: 115664-37-4
3-(4⁽⁵⁾-imidazolylmethyl)-2-methylbenzyl alcohol

Guidance literature:: Multi-step reaction with 5 steps

1: 86 percent / LiBr, p-TsOH / Ambient temperature

2: 1.) Mg, 1,2-dibromoethane / 1.) THF, reflux, 6.5 h, 2.) THF, RT, overnight

3: 90 percent / MnO₂ / CHCl₃ / 1 h / Heating

4: 51 percent / KOH, hydrazine hydrate / ethane-1,2-diol / 2 h / 200 °C

5: 58 percent / aq. HCl / 2.5 h / 110 - 120 °C

With hydrogenchloride; manganese(IV) oxide; potassium hydroxide; toluene-4-sulfonic acid; hydrazine hydrate; magnesium; ethylene dibromide; lithium bromide; In chloroform; ethylene glycol;