4'-Hydroxy-4-biphenylcarboxylic acid

Base Information

• Chemical Name: 4'-Hydroxy-4-biphenylcarboxylic acid
• CAS No.: 58574-03-1
• Molecular Formula: C13H10O3
• Molecular Weight: 214.221
• Hs Code.: 29163990
• European Community (EC) Number: 628-295-7
• NSC Number: 179419
• DSSTox Substance ID: DTXSID60306717
• Nikkaji Number: J208.616F
• Wikidata: Q63409165
• ChEMBL ID: CHEMBL90522
• Mol file: 58574-03-1.mol

Synonyms:58574-03-1;4'-Hydroxy-4-biphenylcarboxylic acid;4-(4-Hydroxyphenyl)benzoic acid;4'-Hydroxybiphenyl-4-carboxylic Acid;4'-Hydroxy-[1,1'-biphenyl]-4-carboxylic acid;4-Hydroxy-4'-biphenylcarboxylic acid;4'-Hydroxy biphenyl-4-carboxylic acid;[1,1'-Biphenyl]-4-carboxylic acid, 4'-hydroxy-;MFCD00059078;4-Hydroxybiphenyl-4'-carboxylic acid;CHEMBL90522;4'-Hydroxy[1,1'-biphenyl]-4-carboxylic acid;4-(4'-hydroxyphenyl)benzoic acid;4'-Hydroxy-biphenyl-4-carboxylic acid;NSC179419;Oprea1_635193;SCHEMBL371652;4-(p-Hydroxyphenyl)benzoic acid;4'-Hydroxy-4-phenylbenzoic acid;AMY1111;DTXSID60306717;4-(4'-hydroxyphenyl) benzoic acid;4-(4-hydroxy-phenyl)-benzoic acid;BCP19456;4'-Hydroxybiphenyl4-carboxylic acid;4-(4-CARBOXYPHENYL)-PHENOL;BBL104233;BDBM50060981;STL282774;4'-hydroxy 4-biphenylcarboxylic acid;4'-hydroxyl-4-biphenylcarboxylic acid;4-hydroxy-biphenyl-4'-carboxylic acid;4-hydroxylbiphenyl-4'-carboxylic acid;AKOS000120984;NSC-179419;SB66858;4''-Hydroxy-biphenyl-4-carboxylic acid;4-Biphenylcarboxylic acid, 4'-hydroxy-;AC-26583;BP-12681;DS-14558;SY036808;4'-Hydroxy-4-biphenylcarboxylic acid, 99%;BB 0223343;CS-0012227;FT-0618652;H0695;4'-hydroxy-1,1'-biphenyl-4-carboxylic acid;4'-hydroxy[1,1']biphenyl-4-carboxylic acid;EN300-17216;W-203197;Q63409165;Z56899120;InChI=1/C13H10O3/c14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16/h1-8,14H,(H,15,16

Chemical Property of 4'-Hydroxy-4-biphenylcarboxylic acid

Chemical Property:

• Appearance/Colour: Powder
• Melting Point: 295 °C (dec.)(lit.)
• Refractive Index: 1.5090 (estimate)
• Boiling Point: 420.4 °C at 760 mmHg
• PKA: 4.29±0.10(Predicted)
• Flash Point: 222.2 °C
• PSA: 57.53000
• Density: 1.292 g/cm³
• LogP: 2.75740
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: almost transparency in hot Methanol
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 214.062994177
• Heavy Atom Count: 16
• Complexity: 236

Purity/Quality:

99% ^*data from raw suppliers

4-(4-Hydroxyphenyl)benzoic Acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-37/38-36
• Safety Statements: 26-37/39-37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)O)C(=O)O
• Uses: 4-(4-Hydroxyphenyl)benzoic acid Dyes and metabolites. Intermediates of Liquid Crystals

Technology Process of 4'-Hydroxy-4-biphenylcarboxylic acid

There total 8 articles about 4'-Hydroxy-4-biphenylcarboxylic 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:

methyl 4-hydroxylbenzoate (99-76-3,156291-94-0) + isopropenylbenzene (98-83-9,6144-04-3,25014-31-7,42612-14-6) + phenol (108-95-2,27073-41-2) → Isopropylbenzene (98-82-8) + 4'-Hydroxybiphenyl-4-carboxylic acid (58574-03-1)

Guidance literature:

With hydrogenchloride; propan-1-ol; sodium hydroxide; hydrogen; palladium-carbon catalyst; In water; benzene;

Reference yield:

→ Isopropylbenzene (98-82-8) + 4'-Hydroxybiphenyl-4-carboxylic acid (58574-03-1)

Guidance literature:

Reference yield:

formic acid (64-18-6) + biphenyl (92-52-4,1594-86-1) → 4,4'-Dihydroxybiphenyl (92-88-6) + 4'-Hydroxybiphenyl-4-carboxylic acid (58574-03-1) + 4'-hydroxy-1,1'-biphenyl-3-carboxylic acid (121629-21-8)

Guidance literature:

With dipotassium peroxodisulfate; trifluoroacetic acid; palladium(II) trifluoroacetate; In dichloromethane; at 50 ℃; for 48h;

DOI:10.1021/ol049166l

upstream raw materials:

formic acid

biphenyl

4-bromo-4'-hydroxybiphenyl

4,4-bis(4-hydroxyphenyl)cyclohexanecarboxylic acid ester

Downstream raw materials:

4-<4'-(butyloxy)phenyl>benzoic acid

4'-ethoxy-biphenyl-4-carboxylic acid

4-methylcarbonyloxybiphenyl-4'-carboxylic acid

4'-propyloxy-4-biphenylcarboxylic acid

Refernces

Non-chiral compounds exhibiting alternating tilt smectic phases

10.1080/10587259508038683

The research investigates the liquid crystal properties of non-chiral and racemic branched alkyl chain molecules, specifically focusing on their ability to exhibit alternating tilt smectic phases. The purpose of the study was to understand how variations in the molecular structure, particularly the branching of terminal alkyl chains and the nature of the linking groups, influence the phase behavior of these compounds. The findings indicate that increased branching enhances the stability of alternating tilt smectic phases while suppressing other smectic phases. The study utilized various chemicals, including methyl 4-hydroxycinnamate, alkyl bromides, 4-hydroxybiphenyl-4'-carboxylic acid, and diethylazodicarboxylate (DEAD), in the synthesis of the target compounds. The results suggest that the molecular geometry and steric factors significantly impact the phase behavior of non-chiral liquid crystals.

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