Imidazole-1-butyric acid, ethyl ester

Base Information

Chemical Name:Imidazole-1-butyric acid, ethyl ester
CAS No.:72338-57-9
Molecular Formula:C9H14N2O2
Molecular Weight:182.2197
Hs Code.:
DSSTox Substance ID:DTXSID80222667
Wikidata:Q83100979

Synonyms:Imidazole-1-butyric acid, ethyl ester;BRN 0517443;Ethyl 1H-imidazol-1-ylbutanoate;72338-57-9;1H-Imidazole-1-butanoic acid, ethyl ester;ethyl 4-imidazol-1-ylbutanoate;SCHEMBL941695;ethyl 4-(1-imidazolyl)butyrate;BDBM84681;1-Subsituted 1H-imidazole, 18;DTXSID80222667;RDNHWIOBCYOAMM-UHFFFAOYSA-N;ethyl 4-(1h-imidazol-1-yl)butanoate;LS-78127

Suppliers and Price of Imidazole-1-butyric acid, ethyl 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
1H-Imidazole-1-butanoicacid,ethylester 97.00%
5G
$ 1700.00

Total 0 raw suppliers

Chemical Property of Imidazole-1-butyric acid, ethyl ester

Chemical Property:

Vapor Pressure:0.000176mmHg at 25°C
Boiling Point:329.5°C at 760 mmHg
PKA:6.96±0.10(Predicted)
Flash Point:153.1°C
PSA：44.12000
Density:1.08g/cm³
LogP:1.22640
XLogP3:0.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:182.105527694
Heavy Atom Count:13
Complexity:162

Purity/Quality:: 1H-Imidazole-1-butanoicacid,ethylester 97.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)CCCN1C=CN=C1

Technology Process of Imidazole-1-butyric acid, ethyl ester

There total 7 articles about Imidazole-1-butyric acid, ethyl 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: 30.0%

: 1,1-bis(4-fluorophenyl)-4-(1-imidazolyl)butanol

: 72338-57-9
ethyl 4-(imidazol-1-yl)butyrate

Guidance literature:

Reference yield:

: 288-32-4
1H-imidazole

: 2969-81-5
Ethyl 4-bromobutyrate

: 72338-57-9
ethyl 4-(imidazol-1-yl)butyrate

Guidance literature:: With potassium carbonate; In butanone; Heating;

Reference yield:

: 2969-81-5
Ethyl 4-bromobutyrate

: 72338-57-9
ethyl 4-(imidazol-1-yl)butyrate

Guidance literature:: Multi-step reaction with 2 steps

1: acetonitrile / 3 h / Heating

2: Na, EtOH / 0.05 h / Ambient temperature

With ethanol; sodium; In acetonitrile;
DOI:10.1055/s-1994-25414