ISOPHTHALIC ACID, DIISOBUTYL ESTER

bis(2-methylpropyl) benzene-1,3-dicarboxylate

CAS: 1528-64-9

Molecular Formula	`C16H22O4`
Molecular Weight	278.34 g/mol
LogP	4.3
Topological Polar Surface Area	52.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	278.1518
Heavy Atoms	20
Complexity	292.0

Chemical Identifiers

CAS Number	1528-64-9
SMILES	`CC(C)COC(=O)C1=CC(=CC=C1)C(=O)OCC(C)C`
InChIKey	`LKUXNJPSPNDDLI-UHFFFAOYSA-N`

📖 Product Overview

ISOPHTHALIC ACID, DIISOBUTYL ESTER (CAS: 1528-64-9) is a chemical compound with molecular formula C16H22O4 and molecular weight 278.34 g/mol. Its IUPAC systematic name is bis(2-methylpropyl) benzene-1,3-dicarboxylate. LogP 4.3 Topological Polar Surface Area 52.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 278.1518 Heavy Atoms 20 Complexity 292.0 InChI Key: LKUXNJPSPNDDLI-UHFFFAOYSA-N. SMILES: CC(C)COC(=O)C1=CC(=CC=C1)C(=O)OCC(C)C.

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