Dimethyl phthalate-3,4,5,6-d4

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CATAPS93951894
CAS93951-89-4
Structure
MDL NumberMFCD00144144
IUPAC Namedimethyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate
Molecular Weight198.21
Molecular FormulaC102H4H6O4
Canonical SMILES[2H]c1c([2H])c([2H])c(C(=O)OC)c(C(=O)OC)c1[2H]
InChIInChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3/i3D,4D,5D,6D
InChI KeyNIQCNGHVCWTJSM-LNFUJOGGSA-N
Descriptionanalytical standard
Accurate Mass198.083
BP282 °C (lit.)
Formneat; gas chromatography (GC): suitable
FormatNeat
Gradeanalytical standard
Linear FormulaC6D4(CO2CH3)2
MP2 °C (lit.)
Product TypeStable Isotope Labelled
Refractive Indexn20/D 1.515 (lit.)
ShippingRoom Temperature
Size2.5MG
Storage ConditionsRoom Temperature
SubcategoryPhthalates, Stable isotope labelled compounds
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