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3-(1H-Indol-3-Yl)-1(3H)-Isobenzofuranone
[CAS# 6936-87-4]

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Identification
Name 3-(1H-Indol-3-Yl)-1(3H)-Isobenzofuranone
Synonyms 3-(1H-Indol-3-Yl)-3H-Isobenzofuran-1-One; Nsc42087; Oprea1_585114
Molecular Structure CAS#: 6936-87-4, 3-(1H-Indol-3-Yl)-1(3H)-Isobenzofuranone
Molecular Formula C16H11NO2
Molecular Weight 249.27
CAS Registry Number 6936-87-4
SMILES C1=CC=CC2=C1[NH]C=C2C3C4=C(C(O3)=O)C=CC=C4
InChI 1S/C16H11NO2/c18-16-12-7-2-1-6-11(12)15(19-16)13-9-17-14-8-4-3-5-10(13)14/h1-9,15,17H
InChIKey NFKMAYYHLXEVDM-UHFFFAOYSA-N
Properties
Density 1.364g/cm3 (Cal.)
Boiling point 492.315°C at 760 mmHg (Cal.)
Flash point 251.543°C (Cal.)
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