Parconazole

Base Information

• Chemical Name: Parconazole
• CAS No.: 61400-59-7
• Molecular Formula: C₁₇H₁₆Cl₂N₂O₃
• Molecular Weight: 367.232
• European Community (EC) Number: 272-080-7
• UNII: 8Z2Z19C8Z1
• DSSTox Substance ID: DTXSID601016135
• Nikkaji Number: J238.733F
• Wikidata: Q27271224
• NCI Thesaurus Code: C66316
• ChEMBL ID: CHEMBL4799571
• Mol file: 61400-59-7.mol

Synonyms:Parconazole;Parconazole [INN];EINECS 272-080-7;1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole;61400-59-7;8Z2Z19C8Z1;68685-54-1;cis-(1)-1-((2-(2,4-Dichlorophenyl)-4-((prop-2-ynyloxy)methyl)-1,3-dioxolan-2-yl)methyl)-1H-imidazole;UNII-8Z2Z19C8Z1;R-39500;SCHEMBL1044835;CHEMBL4799571;DTXSID601016135;CIS-1-((2-(2,4-DICHLOROPHENYL)-4-((2-PROPYNYLOXY)METHYL)-1,3-DIOXOLAN-2-YL)METHYL)IMIDAZOLE;Q27271224;1-[[2-(2,4-Dichlorophenyl)-4alpha-[(2-propynyloxy)methyl]-1,3-dioxolan-2alpha-yl]methyl]-1H-imidazole;1H-IMIDAZOLE, 1-((2-(2,4-DICHLOROPHENYL)-4-((2-PROPYNYLOXY)METHYL)-1,3-DIOXOLAN-2-YL)METHYL)-;Cis-(+-)-1-[[2-(2,4-dichlorophenyl)-4-[(prop-2-ynyloxy)methyl]-1,3-dioxolan-2-yl]methyl]-1H-imidazole

Chemical Property of Parconazole

Chemical Property:

• Vapor Pressure: 8.82E-12mmHg at 25°C
• Refractive Index: 1.589
• Boiling Point: 554.8°C at 760 mmHg
• Flash Point: 289.3°C
• PSA: 45.51000
• Density: 1.31g/cm³
• LogP: 3.10810
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 366.0537978
• Heavy Atom Count: 24
• Complexity: 472

Purity/Quality:

PARCONAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C#CCOCC1COC(O1)(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl
• Isomeric SMILES: C#CCOC[C@@H]1CO[C@@](O1)(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl
• Uses: Antifungal.

Technology Process of Parconazole

There total 2 articles about Parconazole 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:

→ 1-[2-(2,4-dichloro-phenyl)-4-prop-2-ynyloxymethyl-[1,3]dioxolan-2-ylmethyl]-1H-imidazole (61400-59-7,68685-54-1,68685-61-0,79156-74-4)

Guidance literature:

3-Chlor-prop-1-in, entspr. Alkohol;

Reference yield:

→ 1-[(2R,4S)-2-(2,4-Dichloro-phenyl)-4-prop-2-ynyloxymethyl-[1,3]dioxolan-2-ylmethyl]-1H-imidazole (61400-59-7,68685-54-1,68685-61-0,79156-74-4)

Guidance literature:

cis-2-(1H-Imidazol-1-ylmethyl)-2-(2,4-dichlorophenyl)-4-hydroxymethyl-1,3-dioxolan, NaH/3-Chlorpropin;