Isophthalic acid

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CATAPS121915
CAS121-91-5
Structure
MDL NumberMFCD00002516
IUPAC Namebenzene-1,3-dicarboxylic acid
Molecular Weight166.13
Molecular FormulaC8H6O4
EC Number204-506-4
Canonical SMILESOC(=O)c1cccc(c1)C(=O)O
InChIInChI=1S/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)
InChI KeyQQVIHTHCMHWDBS-UHFFFAOYSA-N
REAXYS Number1909332
Descriptionanalytical standard
Accurate Mass166.0266
Assay≥97.0% (GC)
Autoignition Temperature1198 °F; gas chromatography (GC): suitable
Formneat
FormatNeat
Gradeanalytical standard
Linear FormulaC6H4-1,3-(CO2H)2
MP341-343 °C (lit.)
ShippingRoom Temperature
Size50MG
Storage Conditions+20°C
SubcategoryPhthalates
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