Tripropyl citrate

Base Information

• Chemical Name: Tripropyl citrate
• CAS No.: 1587-21-9
• Molecular Formula: C15H26 O7
• Molecular Weight: 318.367
• Hs Code.: 2918150000
• European Community (EC) Number: 216-450-8
• DSSTox Substance ID: DTXSID60166499
• Nikkaji Number: J206.827C
• Wikidata: Q83035677
• Mol file: 1587-21-9.mol

Synonyms:Tripropyl citrate;1587-21-9;Citric acid tri-N-propyl ester;tripropyl 2-hydroxypropane-1,2,3-tricarboxylate;Citric Acid Tripropyl Ester;CITRICACIDTRI-N-PROPYLESTER;EINECS 216-450-8;AI3-05012;1,2,3-Propanetricarboxylic acid, 2-hydroxy-, tripropyl ester;SCHEMBL398062;DTXSID60166499;C15H26O7;1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 1,2,3-tripropyl ester;MFCD00059407;AKOS015839594;AS-72055;C0601;CS-0324273;FT-0728232;D89277;tripropyl 2-hydroxy-1,2,3-propanetricarboxylate;1,2,3-tripropyl 2-hydroxypropane-1,2,3-tricarboxylate

Chemical Property of Tripropyl citrate

Chemical Property:

• Vapor Pressure: 4.36E-06mmHg at 25°C
• Refractive Index: 1.4420-1.4450
• Boiling Point: 198oC / 13mmHg
• PKA: 11.30±0.29(Predicted)
• Flash Point: 109oC
• PSA: 99.13000
• Density: 1.08 g/cm3
• LogP: 1.35730
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 14
• Exact Mass: 318.16785316
• Heavy Atom Count: 22
• Complexity: 343

Purity/Quality:

98%,99%, ^*data from raw suppliers

Tripropyl2-Hydroxypropane-1,2,3-tricarboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOC(=O)CC(CC(=O)OCCC)(C(=O)OCCC)O

Technology Process of Tripropyl citrate

There total 2 articles about Tripropyl citrate 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: 99.0%

propan-1-ol (71-23-8) + citric acid (77-92-9,906507-37-7) → tri-n-propyl citrate (1587-21-9)

Guidance literature:

With NKC-9; In cyclohexane; at 90 - 92 ℃;

Reference yield:

→ tri-n-propyl citrate (1587-21-9)

Guidance literature:

Reference yield:

tri-n-propyl citrate (1587-21-9) + acetyl chloride (75-36-5) → 2-acetoxy-propane-1,2,3-tricarboxylic acid tripropyl ester (6293-73-8)

Guidance literature:

upstream raw materials:

propan-1-ol

citric acid

Downstream raw materials:

2-acetoxy-propane-1,2,3-tricarboxylic acid tripropyl ester

propene-1c,2,3-tricarboxylic acid tripropyl ester

Refernces

• 1、 -. "Preparation method of tripropyl citrate plasticizer". Paragraph 0009; 0013-0017. . Retrieved 2017/03/21.