1H-Imidazole-1-acetic acid, 4-amino-, methyl ester

Base Information

Chemical Name:1H-Imidazole-1-acetic acid, 4-amino-, methyl ester
CAS No.:688041-31-8
Molecular Formula:C₆H₉N₃O₂
Molecular Weight:155.156
Hs Code.:
DSSTox Substance ID:DTXSID90472752
Wikidata:Q82301872
Mol file:688041-31-8.mol

Synonyms:1H-IMIDAZOLE-1-ACETIC ACID, 4-AMINO-, METHYL ESTER;688041-31-8;Methyl 2-(4-aminoimidazol-1-yl)acetate;Methyl 2-(4-amino-1H-imidazol-1-yl)acetate;SCHEMBL1800598;DTXSID90472752;OYHBIULAPFQHHG-UHFFFAOYSA-N;EN300-783488;(4-Amino-imidazol-1-yl)-acetic acid methyl ester

Suppliers and Price of 1H-Imidazole-1-acetic acid, 4-amino-, methyl ester

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
4-amino-1H-Imidazole-1-aceticacidmethylester 97.00%
25G
$ 4010.00

AccelPharmtech
4-amino-1H-Imidazole-1-aceticacidmethylester 97.00%
5G
$ 2180.00

AccelPharmtech
4-amino-1H-Imidazole-1-aceticacidmethylester 97.00%
1G
$ 1940.00

Total 4 raw suppliers

Chemical Property of 1H-Imidazole-1-acetic acid, 4-amino-, methyl ester

Chemical Property:

Boiling Point:379.5±22.0 °C(Predicted)
PKA:6.85±0.61(Predicted)
PSA：70.14000
Density:1.34±0.1 g/cm3(Predicted)
LogP:0.21950
XLogP3:-0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:155.069476538
Heavy Atom Count:11
Complexity:151

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

4-amino-1H-Imidazole-1-aceticacidmethylester 97.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CN1C=C(N=C1)N

Technology Process of 1H-Imidazole-1-acetic acid, 4-amino-, methyl ester

There total 2 articles about 1H-Imidazole-1-acetic acid, 4-amino-, methyl ester 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:

: 13230-21-2
(4-nitro-imidazol-1-yl)-acetic acid methyl ester

: 688041-31-8
(4-amino-imidazol-1-yl)-acetic acid methyl ester

Guidance literature:: With hydrogen; palladium on activated charcoal; In methanol; for 2h; under 2068.59 Torr;
DOI:10.1081/SCC-120021024

Reference yield:

: 688041-31-8
(4-amino-imidazol-1-yl)-acetic acid methyl ester

Guidance literature:

Reference yield:

: 688041-31-8
(4-amino-imidazol-1-yl)-acetic acid methyl ester

: 930100-40-6
C₁₉H₂₂F₂N₄O₄

Guidance literature:: Multi-step reaction with 3 steps

1: O-(1,2-dihydro-2-oxo-1-pyridyl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide

2: trifluoroacetic acid / dichloromethane

3: benzotriazol-1-ol; 1,2-dichloro-ethane; N-ethyl-N,N-diisopropylamine / 20 °C

With benzotriazol-1-ol; O-(1,2-dihydro-2-oxo-1-pyridyl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; 1,2-dichloro-ethane; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1016/j.bmcl.2010.12.117