3,3-Diphenylacrylic acid

Base Information

• Chemical Name: 3,3-Diphenylacrylic acid
• CAS No.: 606-84-8
• Molecular Formula: C15H12O2
• Molecular Weight: 224.259
• Hs Code.: 2916399090
• NSC Number: 120400,16293
• DSSTox Substance ID: DTXSID00209410
• Nikkaji Number: J83.967A
• ChEMBL ID: CHEMBL1771757
• Mol file: 606-84-8.mol

Synonyms:3,3-Diphenylacrylic acid;606-84-8;3,3-diphenylprop-2-enoic acid;2-Propenoic acid, 3,3-diphenyl-;Acido difenililacrilico;beta-Phenylcinnamic acid;ACRYLIC ACID, 3,3-DIPHENYL-;3,3-Diphenyl-2-propenoic acid;M.G. 1779;Acido difenililacrilico [Italian];NSC 16293;NSC 120400;BRN 2049179;4-09-00-02616 (Beilstein Handbook Reference);3,3-DIPHENYLACRYLICACID;ss-Phenyl-zimtsaure;.beta.-Phenylcinnamic acid;3,3-Diphenyl-acrylic acid;SCHEMBL63954;CHEMBL1771757;DTXSID00209410;NSC16293;NSC-16293;NSC120400;AKOS016005378;AS-0325;MG-1779;NSC-120400;LS-14697;CS-0199451;E78666;A927909

Chemical Property of 3,3-Diphenylacrylic acid

Chemical Property:

• Vapor Pressure: 1.86E-05mmHg at 25°C
• Melting Point: 162-164oC
• Boiling Point: 348.7°Cat760mmHg
• Flash Point: 250.8°C
• PSA: 37.30000
• Density: 1.171g/cm³
• LogP: 3.20290
• Storage Temp.: 2-8°C
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 224.083729621
• Heavy Atom Count: 17
• Complexity: 261

Purity/Quality:

97% ^*data from raw suppliers

3,3-Diphenylacrylicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=CC(=O)O)C2=CC=CC=C2

Technology Process of 3,3-Diphenylacrylic acid

There total 71 articles about 3,3-Diphenylacrylic 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: 95.54%

ethyl 3,3-diphenylacrylate (17792-17-5) → 3,3-diphenylacrylic acid (606-84-8)

Guidance literature:

With water; lithium hydroxide; In ethanol; for 3h;

Reference yield: 95.0%

1,1-Diphenylethylene (530-48-3) + carbon dioxide (124-38-9,18923-20-1) → 3,3-diphenylacrylic acid (606-84-8)

Guidance literature:

With 2,6-Dibromopyridine; ethylaluminum dichloride; In hexane; toluene; at 60 ℃; for 3h; under 22502.3 Torr; Reagent/catalyst; Solvent; Catalytic behavior; Autoclave; Inert atmosphere;

DOI:10.1021/acs.orglett.6b00918

Reference yield: 88.0%

3,3-diphenyl-2-propenal (1210-39-5) → 3,3-diphenylacrylic acid (606-84-8)

Guidance literature:

With sodium chlorite; sodium dihydrogenphosphate dihydrate; In water; dimethyl sulfoxide; at 20 ℃; for 9h;

DOI:10.1002/ejoc.201600193

upstream raw materials:

1,1-Diphenylethylene

oxalyl dichloride

Oxalyl bromide

formic acid

Downstream raw materials:

3,3-diphenylacrylamide

3,3-bis-(4-nitro-phenyl)-acrylic acid

3,3-Diphenylpropionic acid

3,3-diphenyl-acrylic acid-(2-diethylamino-ethyl ester); hydrochloride