5-TERT-BUTYLISOPHTHALIC ACID

About This Item

Molecular Formula	C₁₂H₁₄O₄
CAS Number	2359-09-3

FC-0591133

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Properties

Chemical Identifiers

IUPAC Name	5-tert-butylbenzene-1,3-dicarboxylic acid
SMILES	CC(C)(C)C1=CC(=CC(=C1)C(=O)O)C(=O)O
InChI Key	BJLUCDZIWWSFIB-UHFFFAOYSA-N
InChI	InChI=1S/C12H14O4/c1-12(2,3)9-5-7(10(13)14)4-8(6-9)11(15)16/h4-6H,1-3H3,(H,13,14)(H,15,16)

Physical Properties

Boiling Point	400.0±42.0 °C at 760 mmHg
Melting Point	>300 °C(lit.)
Flash Point	209.8±24.4 °C
Density	1.2±0.1 g/cm3

Safety Information

Hazard Class

Warning

Flash Point

209.8±24.4 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.