4-Pentylphenyl 4-methoxybenzoate

Base Information

• Chemical Name: 4-Pentylphenyl 4-methoxybenzoate
• CAS No.: 38444-13-2
• Molecular Formula: C19H22 O3
• Molecular Weight: 298.382
• Hs Code.: 2918990090
• European Community (EC) Number: 253-932-7
• UNII: 5C69KDR77Y
• DSSTox Substance ID: DTXSID3068099
• Nikkaji Number: J31.519B
• Wikidata: Q27261819
• Mol file: 38444-13-2.mol

Synonyms:4-Pentylphenyl 4-methoxybenzoate;38444-13-2;(4-pentylphenyl) 4-methoxybenzoate;p-Pentylphenyl p-anisate;Benzoic acid, 4-methoxy-, 4-pentylphenyl ester;PENTYLPHENYL METHOXYBENZOATE;UNII-5C69KDR77Y;5C69KDR77Y;4-Amylphenyl 4'-methoyxbenzoate;EINECS 253-932-7;4-Methoxybenzoic acid 4-pentylphenyl;4-AMYLPHENYL 4-METHOYXBENZOATE;4-n-Pentylphenyl p-anisate;NEMATEL 105;SCHEMBL508383;4-Pentylphenyl4-methoxybenzoate;DTXSID3068099;ME105;4-n-Pentylphenyl 4-methoxybenzoate;4-AMYLPHENYL4-METHOYXBENZOATE;MFCD08276868;P-AMYLPHENYL P-METHOXYBENZOATE;AKOS015888912;P-PENTYLPHENYL P-METHOXYBENZOATE;4-AMYLPHENYL 4'-METHOXYBENZOATE;4-Pentylphenyl 4-methoxybenzoate, 97%;AS-30880;4-Methoxybenzoic acid 4-pentylphenyl ester;PENTYLPHENYL METHOXYBENZOATE [INCI];PENTYLPHENYL 4-METHOXYBENZOATE, 4-;FT-0658002;P2692;A824155;Q27261819

Chemical Property of 4-Pentylphenyl 4-methoxybenzoate

Chemical Property:

• Vapor Pressure: 1.37E-07mmHg at 25°C
• Melting Point: 28-42 °C
• Boiling Point: 429.7°Cat760mmHg
• Flash Point: 183.2°C
• PSA: 35.53000
• Density: 1.068g/cm³
• LogP: 4.64710
• Storage Temp.: 2-8°C
• Solubility.: soluble in Methanol
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 298.15689456
• Heavy Atom Count: 22
• Complexity: 313

Purity/Quality:

99% ^*data from raw suppliers

4-Pentylphenyl 4-Methoxybenzoate ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,N
• Statements: 36/38-43-50/53
• Safety Statements: 26-37/39-60-61

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC

Technology Process of 4-Pentylphenyl 4-methoxybenzoate

There total 3 articles about 4-Pentylphenyl 4-methoxybenzoate 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:

4-n-pentylphenol (14938-35-3) + 4-methoxy-benzoyl chloride (100-07-2) → p-pentylphenyl p-anisate (38444-13-2)

Guidance literature:

In pyridine;

Reference yield:

4-n-pentylphenol (14938-35-3) + 4-methoxybenzoic acid (100-09-4) → p-pentylphenyl p-anisate (38444-13-2)

Guidance literature:

Reference yield:

→ p-pentylphenyl p-anisate (38444-13-2)

Guidance literature:

/BRN= 471918/, /BRN= 163933/, NaHCO3, Et2O;

upstream raw materials:

4-n-pentylphenol

4-methoxy-benzoyl chloride

4-methoxybenzoic acid

Refernces