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1,3-Dioxo-2-propyl-5-isoindolinecarboxylic acid
[CAS# 67822-76-8]

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Identification
Name 1,3-Dioxo-2-propyl-5-isoindolinecarboxylic acid
Synonyms 1,3-dioxo-2-propyl-2,3-dihydro-1H-isoindole-5-carboxylic acid; 1,3-dioxo-2-propyl-5-isoindolinecarboxylic acid; ChemDiv3_009384
Molecular Structure CAS#: 67822-76-8, 1,3-Dioxo-2-propyl-5-isoindolinecarboxylic acid
Molecular Formula C12H11NO4
Molecular Weight 233.22
CAS Registry Number 67822-76-8
SMILES O=C(O)c1ccc2C(=O)N(C(=O)c2c1)CCC
InChI 1S/C12H11NO4/c1-2-5-13-10(14)8-4-3-7(12(16)17)6-9(8)11(13)15/h3-4,6H,2,5H2,1H3,(H,16,17)
InChIKey CEWDWKPASIXUDQ-UHFFFAOYSA-N
Properties
Density 1.378g/cm3 (Cal.)
Boiling point 432.098°C at 760 mmHg (Cal.)
Flash point 215.125°C (Cal.)
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