Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
Phthalic acid anhydride / Phthalic anhydride 85-44-9 6811

Structure Other Information
Canonical SMILES C1=CC=C2C(=C1)C(=O)OC2=O
Iso SMILES C1=CC=C2C(=C1)C(=O)OC2=O
InChI InChI=1S/C8H4O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-4H
InChI Key LGRFSURHDFAFJT-UHFFFAOYSA-N
Formula C8H4O3
Mol Weight 148.116
XlogP3 1.3
Charge 0

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Synonyms Information
CAS Name isobenzofuran-1,3-dione
IUPAC Name isobenzofuran-1,3-dione
Openeye Name 2-benzofuran-1,3-dione
Systematic Name 2-benzofuran-1,3-dione
Tratitional Name 2-benzofuran-1,3-dione