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Phthalides
Description:
Compounds containing a 3-hydrocarbylidene-2-benzofuran-1(3H)-one moiety,.
Ancestors:
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[1，3]dioxolo[4，5-f]isobenzofuran-5(7H)-oneCas Number: 4792-36-3Formula: C9H6O4 Molecular Weight: 178.1415SMILES: C1C2=CC3=C(C=C2C(=O)O1)OCO3InChIKey: QIYDTIMMZOUCGL-UHFFFAOYSA-NInChI: InChI=1S/C9H6O4/c10-9-6-2-8-7(12-4-13-8)1-5(6)3-11-9/h1-2H,3-4H2 -
4-Methyl-1-oxo-1，3-dihydroisobenzofuran-5-yl trifluoromethanesulfonateCas Number: 1255206-73-5 Compound CID: 86647292Formula: C10H7F3O5S Molecular Weight: 296.22IUPAC Name: (4-methyl-1-oxo-3H-2-benzofuran-5-yl) trifluoromethanesulfonateSMILES: CC1=C(C=CC2=C1COC2=O)OS(=O)(=O)C(F)(F)FInChIKey: VEUQZWVGMYVTMY-UHFFFAOYSA-NInChI: InChI=1S/C10H7F3O5S/c1-5-7-4-17-9(14)6(7)2-3-8(5)18-19(15,16)10(11,12)13/h2-3H,4H2,1H3
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1(3H)-Isobenzofuranone， 4，7-diMethyl-Cas Number: 54598-91-3Formula: C10H10O2 Molecular Weight: 162.1852SMILES: CC1=C2COC(=O)C2=C(C=C1)CInChIKey: JNXGHQDZQVYCKB-UHFFFAOYSA-NInChI: InChI=1S/C10H10O2/c1-6-3-4-7(2)9-8(6)5-12-10(9)11/h3-4H,5H2,1-2H3
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7-Aminoisobenzofuran-1(3H)-oneCas Number: 3883-64-5 Compound CID: 10909726Formula: C8H7NO2 Molecular Weight: 149.15IUPAC Name: 7-amino-3H-2-benzofuran-1-oneSMILES: C1C2=C(C(=CC=C2)N)C(=O)O1InChIKey: ZOKRDQGDSFSYSE-UHFFFAOYSA-NInChI: InChI=1S/C8H7NO2/c9-6-3-1-2-5-4-11-8(10)7(5)6/h1-3H,4,9H2
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5-(4，4，5，5-Tetramethyl-1，3，2-dioxaborolan-2-yl)isobenzofuran-1(3H)-oneCas Number: 862081-37-6 Compound CID: 58074623Formula: C14H17BO4 Molecular Weight: 260.1IUPAC Name: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-2-benzofuran-1-oneSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C(=O)OC3InChIKey: OPVQSJKJDSJOJD-UHFFFAOYSA-NInChI: InChI=1S/C14H17BO4/c1-13(2)14(3,4)19-15(18-13)10-5-6-11-9(7-10)8-17-12(11)16/h5-7H,8H2,1-4H3
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4-Hydroxyisobenzofuran-1(3H)-oneCas Number: 13161-32-5 Compound CID: 12662077Formula: C8H6O3 Molecular Weight: 150.13IUPAC Name: 4-hydroxy-3H-2-benzofuran-1-oneSMILES: C1C2=C(C=CC=C2O)C(=O)O1InChIKey: ZSCIMKFWMUXNBS-UHFFFAOYSA-NInChI: InChI=1S/C8H6O3/c9-7-3-1-2-5-6(7)4-11-8(5)10/h1-3,9H,4H2
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4-ChlorophthalideCas Number: 52010-22-7 Compound CID: 3040300Formula: C8H5ClO2 Molecular Weight: 168.58IUPAC Name: 4-chloro-3H-2-benzofuran-1-oneSMILES: C1C2=C(C=CC=C2Cl)C(=O)O1InChIKey: PLBDNGRGWFOSCH-UHFFFAOYSA-NInChI: InChI=1S/C8H5ClO2/c9-7-3-1-2-5-6(7)4-11-8(5)10/h1-3H,4H2Synonyms: 4-Chloroisobenzofuran-1(3H)-one
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4-Amino-6-fluoroisobenzofuran-1(3H)-oneCas Number: 1207453-91-5 Compound CID: 67258974Formula: C8H6FNO2 Molecular Weight: 167.14IUPAC Name: 4-amino-6-fluoro-3H-2-benzofuran-1-oneSMILES: C1C2=C(C=C(C=C2N)F)C(=O)O1InChIKey: DSZCXDVJAIFZLL-UHFFFAOYSA-NInChI: InChI=1S/C8H6FNO2/c9-4-1-5-6(7(10)2-4)3-12-8(5)11/h1-2H,3,10H2
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1-Oxo-1，3-dihydroisobenzofuran-5-carbaldehydeCas Number: 333333-34-9 Compound CID: 9877463IUPAC Name: 1-oxo-3H-2-benzofuran-5-carbaldehydeSMILES: C1C2=C(C=CC(=C2)C=O)C(=O)O1InChIKey: DBSGLQIKLWDTTD-UHFFFAOYSA-NInChI: InChI=1S/C9H6O3/c10-4-6-1-2-8-7(3-6)5-12-9(8)11/h1-4H,5H2
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7-Nitro-1(3H)-isobenzofuranoneCas Number: 42760-46-3 Compound CID: 848528Formula: C8H5NO4 Molecular Weight: 179.13IUPAC Name: 7-nitro-3H-2-benzofuran-1-oneSMILES: C1C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)O1InChIKey: BFIGXRQYMBKAIR-UHFFFAOYSA-NInChI: InChI=1S/C8H5NO4/c10-8-7-5(4-13-8)2-1-3-6(7)9(11)12/h1-3H,4H2
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6-Chloroisobenzofuran-1(3H)-oneCas Number: 19641-29-3 Compound CID: 7174165Formula: C8H5ClO2 Molecular Weight: 168.58IUPAC Name: 6-chloro-3H-2-benzofuran-1-oneSMILES: C1C2=C(C=C(C=C2)Cl)C(=O)O1InChIKey: NUAVXUHBPNMQEV-UHFFFAOYSA-NInChI: InChI=1S/C8H5ClO2/c9-6-2-1-5-4-11-8(10)7(5)3-6/h1-3H,4H2Synonyms: 6-Chloro-3H-isobenzofuran-1-one
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LEO 39652Cas Number: 1445656-91-6 Compound CID: 71611998Formula: C23H23N3O5 Molecular Weight: 421.45IUPAC Name: 2-methylpropyl 1-[8-methoxy-5-(1-oxo-3H-2-benzofuran-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropane-1-carboxylateSMILES: CC(C)COC(=O)C1(CC1)C2=NN3C(=CC=C(C3=N2)OC)C4=CC5=C(C=C4)C(=O)OC5InChIKey: LUUUHUYQTLUIDG-UHFFFAOYSA-NInChI: InChI=1S/C23H23N3O5/c1-13(2)11-31-22(28)23(8-9-23)21-24-19-18(29-3)7-6-17(26(19)25-21)14-4-5-16-15(10-14)12-30-20(16)27/h4-7,10,13H,8-9,11-12H2,1-3H3
