Uniconazole-P

Base Information

Chemical Name:Uniconazole-P
CAS No.:83657-17-4
Molecular Formula:C15H18ClN3O
Molecular Weight:291.78
Hs Code.:3808939100
European Community (EC) Number:617-481-3,629-782-7
UNII:2T880R8S46
DSSTox Substance ID:DTXSID3035002
Nikkaji Number:J1.108.694B
Wikidata:Q27155601
ChEMBL ID:CHEMBL261837

Synonyms:(S)-E-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazole-1-yl)penten-3-ol;uniconazole-P

Suppliers and Price of Uniconazole-P

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

American Custom Chemicals Corporation
(E)-(S)-1-(4-CHLOROPHENYL)-4,4-DIMETHYL-2-(1H-1,2,4-TRIAZOL-1-YL)-PENT-1-EN-3-OL 95.00%
5MG
$ 495.62

Total 18 raw suppliers

Chemical Property of Uniconazole-P

Chemical Property:

Vapor Pressure:1.52E-09mmHg at 25°C
Melting Point:162～172℃
Refractive Index:1.574
Boiling Point:474.6 °C at 760 mmHg
Flash Point:240.8 °C
PSA：50.94000
Density:1.18 g/cm³
LogP:3.33660
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:291.1138399
Heavy Atom Count:20
Complexity:346

Purity/Quality:

99% ^*data from raw suppliers

(E)-(S)-1-(4-CHLOROPHENYL)-4,4-DIMETHYL-2-(1H-1,2,4-TRIAZOL-1-YL)-PENT-1-EN-3-OL 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C(C(=CC1=CC=C(C=C1)Cl)N2C=NC=N2)O
Isomeric SMILES:CC(C)(C)[C@@H](/C(=C\C1=CC=C(C=C1)Cl)/N2C=NC=N2)O

Technology Process of Uniconazole-P

There total 3 articles about Uniconazole-P 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:

: 83657-22-1,83657-16-3
uniconazole

: 83657-17-4,83657-16-3
(E)-(S)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)-penta-1-ene-3-ol

: 83657-16-3
(R)-(-)-(E)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pent-1-en-3-ol

Guidance literature:: DOI:10.1016/j.bmc.2007.12.019

Reference yield:

: 76713-89-8
(E)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)-1-penten-3-one

: 83657-17-4,83657-16-3
(E)-(S)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)-penta-1-ene-3-ol

: 83657-16-3
(R)-(-)-(E)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pent-1-en-3-ol

Guidance literature:: With sodium tetrahydroborate; (-)-(S)-2-[bis(4-methylphenyl)hydroxymethyl]pyrrolidine hydrochloride; In N,N-dimethyl-formamide; toluene; at 25 ℃; Further Variations:; Reagents; Solvents; Temperatures; Product distribution;
DOI:10.1055/s-2003-44365