2-Ethylhexyl methyl terephthalate

Base Information

• Chemical Name: 2-Ethylhexyl methyl terephthalate
• CAS No.: 63468-13-3
• Molecular Formula: C17H24 O4
• Molecular Weight: 292.375
• Hs Code.: 2917399090
• European Community (EC) Number: 264-249-9
• UNII: 1N3HUI3RDR
• DSSTox Substance ID: DTXSID80979700
• Nikkaji Number: J349.233H
• Wikidata: Q27252636
• Mol file: 63468-13-3.mol

Synonyms:2-Ethylhexyl methyl terephthalate;63468-13-3;4-O-(2-ethylhexyl) 1-O-methyl benzene-1,4-dicarboxylate;UNII-1N3HUI3RDR;1N3HUI3RDR;EINECS 264-249-9;1,4-Benzenedicarboxylic acid, 2-ethylhexyl methyl ester;1-(2-ETHYLHEXYL) 4-METHYL BENZENE-1,4-DICARBOXYLATE;2-ethylhexylmethylterephthalate;SCHEMBL15890908;DTXSID80979700;KHDNBLKBTBOSDJ-UHFFFAOYSA-N;methyl (2-ethylhexyl) terephthalate;BS-18932;CS-0197347;FT-0699357;2-Ethylhexyl methyl benzene-1,4-dicarboxylate;D93016;EN300-7354850;Terephthalic acid 1-(2-ethylhexyl)4-methyl ester;Q27252636;1,4-BENZENEDICARBOXYLIC ACID, 1-(2-ETHYLHEXYL) 4-METHYL ESTER

Chemical Property of 2-Ethylhexyl methyl terephthalate

Chemical Property:

• Vapor Pressure: 0.000152mmHg at 25°C
• Boiling Point: 331.8°C at 760 mmHg
• Flash Point: 174.5°C
• PSA: 52.60000
• Density: 1.039g/cm³
• LogP: 3.84640
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 292.16745924
• Heavy Atom Count: 21
• Complexity: 319

Purity/Quality:

NLT 98% ^*data from raw suppliers

2-ETHYLHEXYL METHYL TEREPHTHALATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)COC(=O)C1=CC=C(C=C1)C(=O)OC

Technology Process of 2-Ethylhexyl methyl terephthalate

There total 1 articles about 2-Ethylhexyl methyl terephthalate 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: 100.0%

1,4-benzenedicarboxylic acid dimethyl ester (120-61-6) + 2-Ethylhexyl alcohol (104-76-7) → methanol (67-56-1) + 2-ethylhexyl methyl terephthalate (63468-13-3)

Guidance literature:

With phosphorus pentoxide; potassium carbonate; Aliquat 336; In neat (no solvent); for 24h; under 20 Torr; Product distribution; Ambient temperature;

DOI:10.1016/S0040-4039(00)80548-1

upstream raw materials:

1,4-benzenedicarboxylic acid dimethyl ester

2-Ethylhexyl alcohol

Refernces