4-Phenylimidazole

Base Information

Chemical Name:4-Phenylimidazole
CAS No.:670-95-1
Molecular Formula:C9H8N2
Molecular Weight:144.176
Hs Code.:29332900
European Community (EC) Number:211-580-1
NSC Number:195337
UNII:8VQ67XR7XY
DSSTox Substance ID:DTXSID30217200
Nikkaji Number:J148.036G
Wikidata:Q27464438
Metabolomics Workbench ID:147785
ChEMBL ID:CHEMBL14145
Mol file:670-95-1.mol

Synonyms:4(5)-phenylimidazole;4-phenylimidazole;5-phenylimidazole;mono-HCl of 4(5)-phenylimidazole

Suppliers and Price of 4-Phenylimidazole

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

TRC
4-Phenylimidazole
5g
$ 495.00

TRC
4-Phenylimidazole
100mg
$ 130.00

TCI Chemical
4-Phenylimidazole >98.0%(T)
5g
$ 93.00

TCI Chemical
4-Phenylimidazole >98.0%(T)
25g
$ 309.00

SynQuest Laboratories
4-Phenyl-1H-imidazole 98%
25 g
$ 224.00

Sigma-Aldrich
4-Phenylimidazole 97%
10g
$ 201.00

Sigma-Aldrich
4-Phenylimidazole 97%
5g
$ 106.00

Matrix Scientific
5-Phenyl-1H-imidazole 95%+
2.500g
$ 420.00

Matrix Scientific
5-Phenyl-1H-imidazole 95%+
100mg
$ 64.00

Matrix Scientific
4-Phenyl-1H-imidazole >95%
1g
$ 149.00

Total 67 raw suppliers

Chemical Property of 4-Phenylimidazole

Chemical Property:

Appearance/Colour:White to beige granular powder
Vapor Pressure:1.24E-05mmHg at 25°C
Melting Point:128-131 °C(lit.)
Refractive Index:1.6200 (estimate)
Boiling Point:379.829 °C at 760 mmHg
PKA:13.58±0.10(Predicted)
Flash Point:213.041 °C
PSA：28.68000
Density:1.142 g/cm³
LogP:2.07670
Storage Temp.:Store below +30°C.
Solubility.:acetone: soluble25mg/mL, clear, colorless to yellow (typical)
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:144.068748264
Heavy Atom Count:11
Complexity:119

Purity/Quality:

98% ^*data from raw suppliers

4-Phenylimidazole ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC=C(C=C1)C2=CN=CN2
Uses An imidazole derivative as antitermite agent. 4-Phenylimidazole was used to investigate the protein-ligand interactions in cytochrome P450 from the thermoacidophile Picrophilus torridus. It was used as heme ligand during the crystallization of recombinant human indoleamine 2,3-dioxygenase. It was used in the synthesis of complexes of copper and cobalt.

Technology Process of 4-Phenylimidazole

There total 52 articles about 4-Phenylimidazole 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: 89.0%

: 15813-09-9
4,5-diiodo-1H-imidazole

: 98-80-6
phenylboronic acid

: 1443425-57-7
4-iodo-1H-imidazolium chloride

: 670-95-1
4-Phenylimidazole

Guidance literature:: 4,5-diiodo-1H-imidazole; phenylboronic acid; With dipotassium hydrogenphosphate; palladium diacetate; XPhos; In methanol; water; at 120 ℃; Inert atmosphere; Microwave irradiation;

With hydrogenchloride; In methanol; water; Inert atmosphere;
DOI:10.1002/adsc.201300395

Reference yield: 86.2%

: 74-90-8
hydrogen cyanide

: 65-85-0,8013-63-6
benzoic acid

: 670-95-1
4-Phenylimidazole

Guidance literature:: hydrogen cyanide; benzoic acid; With ammonium hydroxide; bis(trichloromethyl) carbonate; at 80 ℃; for 24h; under 2250.23 Torr;

With hydrogen; at 60 ℃; for 48h; under 4500.45 Torr;

Reference yield: 85.4%

: 773837-37-9
sodium cyanide

: 100-52-7
benzaldehyde

: 670-95-1
4-Phenylimidazole

Guidance literature:: sodium cyanide; benzaldehyde; With ammonium carbonate; at 100 ℃; for 24h; under 3750.38 Torr;

With sodium tetrahydroborate; at 60 ℃; for 48h; under 0 Torr; Temperature; Pressure; Reagent/catalyst;