Isap acid

Base Information

• Chemical Name: Isap acid
• CAS No.: 133538-58-6
• Molecular Formula: C₂₂H₃₀INO₄S
• Molecular Weight: 531.455
• Mol file: 133538-58-6.mol

Synonyms:7-(6,6-dimethyl-3-(4-iodobenzenesulfonylamino)bicyclo(3.1.1.)hept-2-yl)-5-heptenoic acid;ISAP acid

Chemical Property of Isap acid

Chemical Property:

• Vapor Pressure: 1.49E-15mmHg at 25°C
• Boiling Point: 606.3°Cat760mmHg
• Flash Point: 320.5°C
• PSA: 91.85000
• Density: 1.51g/cm³
• LogP: 6.29320
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 531.09403
• Heavy Atom Count: 29
• Complexity: 707

Purity/Quality:

98.5% ^*data from raw suppliers

I-SAP ≥98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C2CC1C(C(C2)NS(=O)(=O)C3=CC=C(C=C3)I)CC=CCCCC(=O)O)C
• Isomeric SMILES: CC1(C2CC1C(C(C2)NS(=O)(=O)C3=CC=C(C=C3)I)C/C=C/CCCC(=O)O)C

Technology Process of Isap acid

There total 1 articles about Isap acid 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:

→ 7-[(1R,2S,3S,5R)-6,6-dimethyl-3-(4-iodobenzenesulfonylamino) bicyclo[3.1.1]hept-2-yl]-5(Z)-heptenoic acid (133538-58-6)

Guidance literature:

Refernces