Decyl hydrogen phthalate

Base Information

• Chemical Name: Decyl hydrogen phthalate
• CAS No.: 24539-60-4
• Molecular Formula: C18H26 O4
• Molecular Weight: 306.402
• Hs Code.: 2918990090
• European Community (EC) Number: 246-304-9
• DSSTox Substance ID: DTXSID80885271
• Nikkaji Number: J25.906C
• Wikidata: Q82863886
• Mol file: 24539-60-4.mol

Synonyms:24539-60-4;Decyl hydrogen phthalate;2-((Decyloxy)carbonyl)benzoic acid;2-decoxycarbonylbenzoic acid;monodecyl phthalate;2-[(decyloxy)carbonyl]benzoic acid;1,2-Benzenedicarboxylic acid, 1-decyl ester;1,2-Benzenedicarboxylic acid, monodecyl ester;EINECS 246-304-9;MFCD00401823;2-(decyloxycarbonyl)benzoic acid;decyl-hydrogen phthalate;Phthalic acid 1-decyl ester;SCHEMBL302956;Phthalic acid, monodecyl ester;DTXSID80885271;2-((Decyloxy)carbonyl)benzoicacid;ZAA53960;STK369015;AKOS001704365;BS-16765;SY262831;CS-0152165;Y11281

Chemical Property of Decyl hydrogen phthalate

Chemical Property:

• Vapor Pressure: 1.64E-08mmHg at 25°C
• Melting Point: 55-56 °C
• Boiling Point: 439.8°Cat760mmHg
• PKA: 3.38±0.36(Predicted)
• Flash Point: 151.1°C
• PSA: 63.60000
• Density: 1.062g/cm³
• LogP: 4.68230
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 12
• Exact Mass: 306.18310931
• Heavy Atom Count: 22
• Complexity: 327

Purity/Quality:

99% ^*data from raw suppliers

MonodecylPhthalate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)O
• Uses: Decyl hydrogen phthalate is an environmental toxin, used as a catalyst in the analysis of the kinetics crosslinking oligomers in a film. Monodecyl Phthalate is an environmental toxin, used as a catalyst in the analysis of the kinetics crosslinking oligomers in a film.

Technology Process of Decyl hydrogen phthalate

There total 2 articles about Decyl hydrogen phthalate 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: 59.0%

phthalic anhydride (85-44-9) + 1-Decanol (112-30-1) → mono-n-decyl phthalate (24539-60-4)

Guidance literature:

In toluene; for 16h; Reflux; Inert atmosphere;

DOI:10.1021/jacs.9b07269

Reference yield:

→ mono-n-decyl phthalate (24539-60-4)

Guidance literature:

Phthalsaeureanhydrid, n-Decylalkohol;

upstream raw materials:

phthalic anhydride

1-Decanol