1-Ipomeanol

Base Information

• Chemical Name: 1-Ipomeanol
• CAS No.: 34435-70-6
• Molecular Formula: C9H12O3
• Molecular Weight: 168.21
• Hs Code.: 2932190090
• UNII: 8V19Z051YG
• DSSTox Substance ID: DTXSID00955985
• Nikkaji Number: J69.496G
• Wikidata: Q27271053
• Metabolomics Workbench ID: 44419
• Mol file: 34435-70-6.mol

Synonyms:1-(3-furyl)-1-hydroxy-4-pentanone;1-ipomeanol

Chemical Property of 1-Ipomeanol

Chemical Property:

• Vapor Pressure: 0.546mmHg at 25°C
• Refractive Index: 1.4371 (estimate)
• Boiling Point: 181.7°Cat760mmHg
• Flash Point: 63.7°C
• PSA: 50.44000
• Density: 1.121g/cm³
• LogP: 1.68220
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 168.078644241
• Heavy Atom Count: 12
• Complexity: 156

Purity/Quality:

99% ^*data from raw suppliers

(±)-1-Ipomeanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)CCC(C1=COC=C1)O
• Uses: (±)-1-Ipomeanol can be used as analyte involved in analytical study of comparative study on aroma components in purple potato wine during aging.

Technology Process of 1-Ipomeanol

There total 1 articles about 1-Ipomeanol 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-(3-Furyl)-1-hydroxy-4-pentanon (34435-70-6)

Guidance literature:

4-(3-Furyl)butyrolacton, CH3Li;

DOI:10.1021/jo00929a015