2-[4-(Propan-2-yloxy)phenyl]butanedioic acid

Base Information

• Chemical Name: 2-[4-(Propan-2-yloxy)phenyl]butanedioic acid
• CAS No.: 27950-67-0
• Molecular Formula: C13H16O5
• Molecular Weight: 252.26314
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID60396936
• Mol file: 27950-67-0.mol

Synonyms:2-[4-(propan-2-yloxy)phenyl]butanedioic acid;27950-67-0;2-(4-ISOPROPOXY-PHENYL)-SUCCINIC ACID;2-(4-propan-2-yloxyphenyl)butanedioic Acid;2-(4-isopropoxyphenyl)succinic acid;Oprea1_466272;DTXSID60396936;BBL028499;STL372794;AKOS015955685;VS-08802;CS-0358735;2-(4-ISOPROPOXYPHENYL)BUTANEDIOIC ACID

Chemical Property of 2-[4-(Propan-2-yloxy)phenyl]butanedioic acid

Chemical Property:

• PSA: 83.83000
• LogP: 2.11670
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 252.09977361
• Heavy Atom Count: 18
• Complexity: 292

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC1=CC=C(C=C1)C(CC(=O)O)C(=O)O

Technology Process of 2-[4-(Propan-2-yloxy)phenyl]butanedioic acid

There total 1 articles about 2-[4-(Propan-2-yloxy)phenyl]butanedioic 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:

→ p-isopropoxyphenylsuccinic acid (27950-67-0)

Guidance literature:

analog p-Methoxyphenylbernsteinsaeure;

Reference yield:

p-isopropoxyphenylsuccinic acid (27950-67-0) → p-Isopropoxyphenylsuccinic anhydride (32857-73-1)

Guidance literature:

With acetic anhydride; at 100 ℃; for 6h;

DOI:10.32383/appdr/97323

Reference yield:

p-isopropoxyphenylsuccinic acid (27950-67-0) → 1-(2,4-dinitroanilino)-3-(4-isopropoxyphenyl)pyrrolidine-2,5-dione

Guidance literature:

Multi-step reaction with 2 steps

1: acetic anhydride / 6 h / 100 °C

2: acetic acid / Reflux

With acetic anhydride; In acetic acid;

DOI:10.32383/appdr/97323

Downstream raw materials:

6β,6'β-[(Ξ)-2-(4-isopropoxy-phenyl)-succinyldiamino]-bis-penicillanic acid

p-Isopropoxyphenylsuccinic anhydride