Mono[2-(carboxymethyl)hexyl] Phthalate
Product Code
TRC-M525585
CAS Number
Product Format
Neat
Molecular Formula
C16 H20 O6
Molecular Weight
308.33
Product Categories
TRC, Phthalates, Phytochemical Reference Materials and Research Tools
Product Type
MetabolitePurity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
Mono[2-(carboxymethyl)hexyl] Phthalate
CAS Number
82975-93-7
Molecular Formula
C16 H20 O6
Molecular Weight
308.33
Accurate Mass
308.126
SMILES
CCCCC(COC(=O)c1ccccc1C(=O)O)CC(=O)O
InChI
InChI=1S/C16H20O6/c1-2-3-6-11(9-14(17)18)10-22-16(21)13-8-5-4-7-12(13)15(19)20/h4-5,7-8,11H,2-3,6,9-10H2,1H3,(H,17,18)(H,19,20)
IUPAC
2-[2-(carboxymethyl)hexoxycarbonyl]benzoic acid
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
Purity
>95% (HPLC)