Triisobutyl benzene-1,2,4-tricarboxylate

tris(2-methylpropyl) benzene-1,2,4-tricarboxylate

CAS: 1528-52-5

Molecular Formula	`C21H30O6`
Molecular Weight	378.5 g/mol
LogP	5.3
Topological Polar Surface Area	78.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	12
Exact Mass	378.20422
Heavy Atoms	27
Complexity	497.0

Chemical Identifiers

CAS Number	1528-52-5
SMILES	`CC(C)COC(=O)C1=CC(=C(C=C1)C(=O)OCC(C)C)C(=O)OCC(C)C`
InChIKey	`GQBWSGXZXIZPAF-UHFFFAOYSA-N`

📖 Product Overview

Triisobutyl benzene-1,2,4-tricarboxylate (CAS: 1528-52-5) is a chemical compound with molecular formula C21H30O6 and molecular weight 378.5 g/mol. Its IUPAC systematic name is tris(2-methylpropyl) benzene-1,2,4-tricarboxylate. LogP 5.3 Topological Polar Surface Area 78.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 12 Exact Mass 378.20422 Heavy Atoms 27 Complexity 497.0 InChI Key: GQBWSGXZXIZPAF-UHFFFAOYSA-N. SMILES: CC(C)COC(=O)C1=CC(=C(C=C1)C(=O)OCC(C)C)C(=O)OCC(C)C.

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