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Product Overview

Product Code

TRC-M547525

CAS Number

64339-39-5

Product Format

Neat

Molecular Formula

C12H14O5

Molecular Weight

238.24

Product Categories

TRC, Food contact materials

Product Type

Contaminant

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

Mono(2-hydroxyisobutyl)phthalate

CAS Number

64339-39-5

Molecular Formula

C12H14O5

Molecular Weight

238.24

Accurate Mass

238.0841

SMILES

CC(=O)O[C@@H]1CC2[C@@](CC1)(C)[C@H]3[C@@H](CC=2)[C@@H]4[C@@](CC3)(C)C(c5cnccc5)=CC4

InChI

InChI=1S/C12H14O5/c1-12(2,16)7-17-11(15)9-6-4-3-5-8(9)10(13)14/h3-6,16H,7H2,1-2H3,(H,13,14)

IUPAC

2-(2-hydroxy-2-methylpropoxy)carbonylbenzoic acid

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)

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