Chemical Properties of 2-(3-Oxo-1,3-dihydro-2-benzofuran-1-yl)-1h-isoindole-1,3(2h)-dione (CAS 101081-07-6)

2-(3-Oxo-1,3-dihydro-2-benzofuran-1-yl)-1h-isoindole-1,3(2h)-dione

InChI
InChI=1S/C16H9NO4/c18-13-9-5-1-2-6-10(9)14(19)17(13)15-11-7-3-4-8-12(11)16(20)21-15/h1-8,15H
InChI Key
ROOSRPSSNGBKTI-UHFFFAOYSA-N
Formula
C16H9NO4
SMILES
O=C1OC(N2C(=O)c3ccccc3C2=O)c2ccccc21
Molecular Weight1
279.25
CAS
101081-07-6
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Physical Properties

Property Value Unit Source
ω 0.6960 Relay (1.0) Calculated Property
ΔfG° -235.64 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -387.51 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 105.66 kJ/mol Relay (1.0) Calculated Property
IE 9.23 eV Relay (1.0) Calculated Property
log10WS -3.67 Relay (1.0) Calculated Property
logPoct/wat 2.152 Crippen Calculated Property
McVol 187.620 ml/mol McGowan Calculated Property
Pc 2709.62 kPa Relay (1.0-beta) Calculated Property
Tboil 653.90 K Relay (1.0) Calculated Property
Tc 1042.45 K Relay (1.0) Calculated Property
Tfus 440.31 K Relay (1.0) Calculated Property
Vc 0.724 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

3-(Butyl(2-[butyl(3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]ethyl)amino)-2-benzofuran-1(3h)-one. 9,10-Dihydrophenanthrene-cis-9,10-diol, ferrocenylboronate. (-)-2-Aminobutan-1-ol, ferroceneboronate derivative. Tazettine. Retroisosenine. Retroisosensine. Quinapril desethyl 3Me (Quinaprilate 3Me). cis-Acenaphthene-1,2-diol, ferrocenylboronate. 2-Amino-1-propanol, ferrocenylboronate. Acetylsenecivernine. 6-Monoacetylmorphine. Ajmaline. Ergocristine. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Brucine.

Find more compounds similar to 2-(3-Oxo-1,3-dihydro-2-benzofuran-1-yl)-1h-isoindole-1,3(2h)-dione.

Sources

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