4-(TERT-BUTOXY)BENZOIC ACID

Base Information

• Chemical Name: 4-(TERT-BUTOXY)BENZOIC ACID
• CAS No.: 13205-47-5
• Molecular Formula: C11H14O3
• Molecular Weight: 194.23
• Hs Code.: 2918990090
• Mol file: 13205-47-5.mol

Synonyms:Benzoicacid, p-tert-butoxy- (6CI,7CI,8CI);4-(1,1-Dimethylethoxy)benzoic acid;4-tert-Butoxybenzoic acid;

Chemical Property of 4-(TERT-BUTOXY)BENZOIC ACID

Chemical Property:

• Vapor Pressure: 0.000367mmHg at 25°C
• Melting Point: 138-140 °C
• Refractive Index: 1.524
• Boiling Point: 305.1 °C at 760 mmHg
• PKA: 4.49±0.10(Predicted)
• Flash Point: 115.2 °C
• PSA: 46.53000
• Density: 1.106 g/cm³
• LogP: 2.56210
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

97% ^*data from raw suppliers

4-tert-ButoxybenzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-(TERT-BUTOXY)BENZOIC ACID

There total 10 articles about 4-(TERT-BUTOXY)BENZOIC 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: 82.0%

tertiary butyl chloride (507-20-0) + 4-hydroxy-benzoic acid (99-96-7) → 4-tert-butoxybenzoic acid (13205-47-5)

Guidance literature:

With zinc; at 25 ℃; for 1h;

Reference yield: 80.0%

tert-butyl 4-tert-butoxybenzoate → 4-tert-butoxybenzoic acid (13205-47-5)

Guidance literature:

With KSF clay; In acetonitrile; for 3h; Heating;

DOI:10.1055/s-2002-25335

Reference yield: 59.0%

4-fluorobenzonitrile (1194-02-1,143234-87-1) + tert-butyl alcohol (75-65-0) → 4-tert-butoxybenzoic acid (13205-47-5)

Guidance literature:

tert-butyl alcohol; With sodium hydride; In hexane; dimethyl sulfoxide; mineral oil; at 30 ℃; for 0.5h; Inert atmosphere;

4-fluorobenzonitrile; In hexane; dimethyl sulfoxide; mineral oil; at 20 - 60 ℃;

DOI:10.1111/cbdd.12670

upstream raw materials:

4-(tert-butoxy)benzamide

tertiary butyl chloride

4-hydroxy-benzoic acid

tert-butyl 4-cyanophenyl ether

Downstream raw materials:

C₂₉H₄₂N₂O₄

4-tert-butoxy-2-methylbenzoic acid

C₁₂H₁₄N₂O₂S

2-(4-(3-((5-(4-(tert-butoxy)phenyl)-1,3,4-oxadiazol-2-yl)thio)propyl)piperazin-1-yl)benzo[d]oxazole

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