Triisononyl trimellitate

Base Information

• Chemical Name: Triisononyl trimellitate
• CAS No.: 53894-23-8
• Deprecated CAS: 131918-42-8,154213-92-0
• Molecular Formula: C36H60 O6
• Molecular Weight: 588.86
• European Community (EC) Number: 258-847-9
• UNII: T06P0GMA66
• DSSTox Substance ID: DTXSID40274203
• Nikkaji Number: J1.151.813C
• Wikidata: Q27289499
• ChEMBL ID: CHEMBL3185311
• Mol file: 53894-23-8.mol

Synonyms:TRIISONONYL TRIMELLITATE;53894-23-8;tris(7-methyloctyl) benzene-1,2,4-tricarboxylate;890091-51-7;1,2,4-Benzenetricarboxylic acid, triisononyl ester;Triisononyl benzene-1,2,4-tricarboxylate;1,2,4-Benzenetricarboxylic Acid 1,2,4-tris(7-Methyloctyl) Ester;T06P0GMA66;1,2,4-Benzenetricarboxylic acid, 1,2,4-triisononyl ester;1,2,4-tris(7-methyloctyl) benzene-1,2,4-tricarboxylate;UNII-T06P0GMA66;EINECS 258-847-9;JAYFLEX TINTM;ADK CIZER C 9N;ADEKA C 9N;DSSTox_CID_8033;DSSTox_RID_78645;DSSTox_GSID_28033;SCHEMBL811391;CHEMBL3185311;Tris(7-methyloctyl) trimellitate;DTXSID40274203;Tox21_300639;NCGC00248120-01;NCGC00254314-01;CAS-53894-23-8;CS-0238489;CS-0356794;FT-0640198;EN300-19626769;W-111077;Q27289499

Chemical Property of Triisononyl trimellitate

Chemical Property:

• Vapor Pressure: 3.48E-15mmHg at 25°C
• Boiling Point: 617.6°Cat760mmHg
• Flash Point: 248.6°C
• PSA: 78.90000
• Density: 0.98g/cm³
• LogP: 9.97650
• Water Solubility.: 5.4ng/L at 20℃
• XLogP3: 12.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 27
• Exact Mass: 588.43898963
• Heavy Atom Count: 42
• Complexity: 716

Purity/Quality:

99% ^*data from raw suppliers

TRIISONONYL TRIMELLITATE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCC(C)C)C(=O)OCCCCCCC(C)C