Biphenyl-3,3',5,5'-tetracarboxylic acid

Base Information

• Chemical Name: Biphenyl-3,3',5,5'-tetracarboxylic acid
• CAS No.: 4371-28-2
• Molecular Formula: C16H10O8
• Molecular Weight: 330.251
• Hs Code.: 29173990
• European Community (EC) Number: 687-332-5
• DSSTox Substance ID: DTXSID60578790
• Nikkaji Number: J672.634H
• Wikidata: Q72443762
• Mol file: 4371-28-2.mol

Synonyms:4371-28-2;Biphenyl-3,3',5,5'-tetracarboxylic acid;[1,1'-Biphenyl]-3,3',5,5'-tetracarboxylic acid;5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid;MFCD16621475;[1,1'-biphenyl]3,3',5,5'-tetracarboxylic acid;C16H10O8;Biphenyl-3,3,5,5-tetracarboxylic acid;biphenyl-3,3',5,5'- tetracarboxylic acid;YSZC190;[1,1'-biphenyl]-3,3',5,5'-tetracarboxylicacid;SCHEMBL145349;DTXSID60578790;AKOS007930836;CS-W018437;DS-5378;SY053019;B3792;C75173;AU-004/43508027;Biphenyl-3,3 inverted exclamation mark ,5,5 inverted exclamation mark -tetracarboxylic Acid

Chemical Property of Biphenyl-3,3',5,5'-tetracarboxylic acid

Chemical Property:

• Melting Point: >400℃
• Boiling Point: 772.297 °C at 760 mmHg
• PKA: 3.06±0.10(Predicted)
• Flash Point: 434.783 °C
• PSA: 149.20000
• Density: 1.612 g/cm³
• LogP: 2.14640
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 330.03756727
• Heavy Atom Count: 24
• Complexity: 450

Purity/Quality:

97% ^*data from raw suppliers

Biphenyl-3,3',5,5'-tetracarboxylic Acid >98.0%(HPLC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): N
• Hazard Codes: N
• Statements: 50
• Safety Statements: 61

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=C(C=C(C=C1C(=O)O)C(=O)O)C2=CC(=CC(=C2)C(=O)O)C(=O)O
• Uses: Selected Applications of MOFs in Sustainable Energy Technologies

Technology Process of Biphenyl-3,3',5,5'-tetracarboxylic acid

There total 8 articles about Biphenyl-3,3',5,5'-tetracarboxylic 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: 89.0%

tetramethyl [1,1'-biphenyl]-3,3',5,5'-tetracarboxylate (109936-20-1) → biphenyl-3,3',5,5'-tetracarboxylic acid (4371-28-2)

Guidance literature:

With sodium hydroxide; In tetrahydrofuran; water; for 5h; Heating;

DOI:10.1021/jo0610309

Reference yield: 82.0%

3,3',5,5'-tetramethyl-1,1'-biphenyl (25570-02-9) → biphenyl-3,3',5,5'-tetracarboxylic acid (4371-28-2)

Guidance literature:

With potassium permanganate; water; sodium hydroxide; In tert-butyl alcohol; at 50 - 70 ℃; for 216h;

Reference yield:

tetrabutyl biphenyl-3,3',5,5'-tetracarboxylate → biphenyl-3,3',5,5'-tetracarboxylic acid (4371-28-2)

Guidance literature:

With potassium hydroxide; In tetrahydrofuran; water; Reflux;

DOI:10.1055/a-1587-8859

upstream raw materials:

tetramethyl [1,1'-biphenyl]-3,3',5,5'-tetracarboxylate

3,3',5,5'-tetramethyl-1,1'-biphenyl

dimethyl 5-(pinacolboryl)isophthalate

5-iodo-isophthalic acid dimethyl ester