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Benzofuranones
Description:
Organic compounds containing a benzene ring fused to a furanone.
Ancestors:
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o-CresolphthaleinCas Number: 596-27-0 EC Number: 209-881-8Formula: C22H18O4 Molecular Weight: 346.38IUPAC Name: 3,3-bis(4-hydroxy-3-methylphenyl)-2-benzofuran-1-oneSMILES: CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4)O)C)OInChIKey: CPBJMKMKNCRKQB-UHFFFAOYSA-NInChI: InChI=1S/C22H18O4/c1-13-11-15(7-9-19(13)23)22(16-8-10-20(24)14(2)12-16)18-6-4-3-5-17(18)21(25)26-22/h3-12,23-24H,1-2H3Synonyms: o-Cresolphthalein|596-27-0|1(3H)-Isobenzofuranone, 3,3-bis(4-hydroxy-3-methylphenyl)-|3,3-Bis(4-hydroxy-3-methylpheny...
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Xylenol Blue IndicatorFormula: C23H22O5S Molecular Weight: 410.48IUPAC Name: 4-[3-(4-hydroxy-2,5-dimethylphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]-2,5-dimethylphenolSMILES: CC1=CC(=C(C=C1O)C)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=C(C=C(C(=C4)C)O)CInChIKey: MGUKYHHAGPFJMC-UHFFFAOYSA-NInChI: InChI=1S/C23H22O5S/c1-13-11-20(24)15(3)9-18(13)23(19-10-16(4)21(25)12-14(19)2)17-7-5-6-8-22(17)29(26,27)28-23/h5-12,24-25H,1-4H3Synonyms: X0026 | X-6800 | NCGC00091153-01 | starbld0016709 | XYLENOL BLUE, P- | 1,4-dimethyl-5-hydroxybenzenesulfonephthalein ...
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Thymolblue-Phenolphthalein indicatorFormula: C27H30O5S Molecular Weight: 466.59IUPAC Name: 4-[3-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]-5-methyl-2-propan-2-ylphenolSMILES: CC1=CC(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)OInChIKey: PRZSXZWFJHEZBJ-UHFFFAOYSA-NInChI: InChI=1S/C27H30O5S/c1-15(2)19-13-22(17(5)11-24(19)28)27(21-9-7-8-10-26(21)33(30,31)32-27)23-14-20(16(3)4)25(29)12-18(23)6/h7-16,28-29H,1-6H3Synonyms: Thymol Bleu | Phenol, 4,4'-(3H-2,1-benzoxathiol-3-ylidene)bis(5-methyl-2-(1-methylethyl)-, S,S-dioxide | E70392 | 4-[...
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Thymolblue indicatorFormula: C27H30O5S Molecular Weight: 466.59IUPAC Name: 4-[3-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]-5-methyl-2-propan-2-ylphenolSMILES: CC1=CC(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)OInChIKey: PRZSXZWFJHEZBJ-UHFFFAOYSA-NInChI: InChI=1S/C27H30O5S/c1-15(2)19-13-22(17(5)11-24(19)28)27(21-9-7-8-10-26(21)33(30,31)32-27)23-14-20(16(3)4)25(29)12-18(23)6/h7-16,28-29H,1-6H3Synonyms: Thymol blue|76-61-9|Thymolsulfonephthalein|Thymolsulfophthalein|Thymosulfonphthalein|Thymolsulfonphthalein|Thymolsulp...
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TalniflumateCas Number: 66898-62-2 Compound CID: 48229Formula: C21H13F3N2O4 Molecular Weight: 414.34IUPAC Name: (3-oxo-1H-2-benzofuran-1-yl) 2-[3-(trifluoromethyl)anilino]pyridine-3-carboxylateSMILES: C1=CC=C2C(=C1)C(OC2=O)OC(=O)C3=C(N=CC=C3)NC4=CC=CC(=C4)C(F)(F)FInChIKey: ANMLJLFWUCQGKZ-UHFFFAOYSA-NInChI: InChI=1S/C21H13F3N2O4/c22-21(23,24)12-5-3-6-13(11-12)26-17-16(9-4-10-25-17)19(28)30-20-15-8-2-1-7-14(15)18(27)29-20/h1-11,20H,(H,25,26)Synonyms: Talniflumate|66898-62-2|Somalgen|Lomucin|Talniflumato|BA 7602-06|Ba-7602-06|Phthalidyl 2-(3-trifluoromethylanilino)ni...
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RU.521Cas Number: 2262452-06-0 Compound CID: 135397653Formula: C19H12Cl2N4O3 Molecular Weight: 415.23IUPAC Name: 2-(4,5-dichloro-1H-benzimidazol-2-yl)-5-methyl-4-(3-oxo-1H-2-benzofuran-1-yl)-1H-pyrazol-3-oneSMILES: CC1=C(C(=O)N(N1)C2=NC3=C(N2)C=CC(=C3Cl)Cl)C4C5=CC=CC=C5C(=O)O4InChIKey: IAWZUQAOMURCLV-UHFFFAOYSA-NInChI: InChI=1S/C19H12Cl2N4O3/c1-8-13(16-9-4-2-3-5-10(9)18(27)28-16)17(26)25(24-8)19-22-12-7-6-11(20)14(21)15(12)23-19/h2-7,16,24H,1H3,(H,22,23)Synonyms: RU320521 | 3-[1-(6,7-dichloro-1H-benzimidazol-2-yl)-5-hydroxy-3-methyl-pyrazol-4-yl]-3H-isobenzofuran-1-one
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RU.521Cas Number: 2262452-06-0 Compound CID: 135397653Formula: C19H12Cl2N4O3 Molecular Weight: 415.23IUPAC Name: 2-(4,5-dichloro-1H-benzimidazol-2-yl)-5-methyl-4-(3-oxo-1H-2-benzofuran-1-yl)-1H-pyrazol-3-oneSMILES: CC1=C(C(=O)N(N1)C2=NC3=C(N2)C=CC(=C3Cl)Cl)C4C5=CC=CC=C5C(=O)O4InChIKey: IAWZUQAOMURCLV-UHFFFAOYSA-NInChI: InChI=1S/C19H12Cl2N4O3/c1-8-13(16-9-4-2-3-5-10(9)18(27)28-16)17(26)25(24-8)19-22-12-7-6-11(20)14(21)15(12)23-19/h2-7,16,24H,1H3,(H,22,23)Synonyms: RU320521 | 3-[1-(6,7-dichloro-1H-benzimidazol-2-yl)-5-hydroxy-3-methyl-pyrazol-4-yl]-3H-isobenzofuran-1-one
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Phenolphthalein-Nile Blue indicatorCas Number: 77-09-8 EC Number: 201-004-7Formula: C20H14O4 Molecular Weight: 318.33IUPAC Name: 3,3-bis(4-hydroxyphenyl)-2-benzofuran-1-oneSMILES: C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)OInChIKey: KJFMBFZCATUALV-UHFFFAOYSA-NInChI: InChI=1S/C20H14O4/c21-15-9-5-13(6-10-15)20(14-7-11-16(22)12-8-14)18-4-2-1-3-17(18)19(23)24-20/h1-12,21-22HSynonyms: Agoral (Salt/Mix) | Colax | Fenolftaleina [INN-Spanish] | Phenolphthalein (INN) | 3,3-Bis(4-hydroxyphenyl)-1(3H)-isob...
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Phenolphthalein Disodium SaltCas Number: 518-51-4 Compound CID: 68206Formula: C20H12O4Na2 Molecular Weight: 362.29IUPAC Name: disodium;4-[1-(4-oxidophenyl)-3-oxo-2-benzofuran-1-yl]phenolateSMILES: C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)[O-])C4=CC=C(C=C4)[O-].[Na+].[Na+]InChIKey: GCZXTTJWUAJLNQ-UHFFFAOYSA-LInChI: InChI=1S/C20H14O4.2Na/c21-15-9-5-13(6-10-15)20(14-7-11-16(22)12-8-14)18-4-2-1-3-17(18)19(23)24-20;;/h1-12,21-22H;;/q;2*+1/p-2Synonyms: DTXSID3060162 | disodium;4-[1-(4-oxidophenyl)-3-oxo-2-benzofuran-1-yl]phenolate | SCHEMBL951289 | Phenolphthalein Dis...
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PhenolphthaleinCas Number: 77-09-8 EC Number: 201-004-7Formula: C20H14O4 Molecular Weight: 318.33IUPAC Name: 3,3-bis(4-hydroxyphenyl)-2-benzofuran-1-oneSMILES: C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)OInChIKey: KJFMBFZCATUALV-UHFFFAOYSA-NInChI: InChI=1S/C20H14O4/c21-15-9-5-13(6-10-15)20(14-7-11-16(22)12-8-14)18-4-2-1-3-17(18)19(23)24-20/h1-12,21-22HSynonyms: phenolphthalein|77-09-8|Phthalimetten|Euchessina|Phthalin|Espotabs|Phenolax|Purgophen|Koprol|Laxogen|Trilax|Purga|Spu...
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Phenol red indicatorCas Number: 143-74-8Formula: C19H14O5S Molecular Weight: 354.38IUPAC Name: 4-[3-(4-hydroxyphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]phenolSMILES: C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC=C(C=C3)O)C4=CC=C(C=C4)OInChIKey: BELBBZDIHDAJOR-UHFFFAOYSA-NInChI: InChI=1S/C19H14O5S/c20-15-9-5-13(6-10-15)19(14-7-11-16(21)12-8-14)17-3-1-2-4-18(17)25(22,23)24-19/h1-12,20-21HSynonyms: PHENOL RED|phenolsulfonphthalein|143-74-8|Fenolipuna|Sulfonphthal|Sulphental|Sulphonthal|Phenolsulphonphthalein|Pheno...
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Phenol Red sodium saltFormula: C19H13NaO5S Molecular Weight: 376.36IUPAC Name: sodium;4-[3-(4-hydroxyphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]phenolateSMILES: C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC=C(C=C3)O)C4=CC=C(C=C4)[O-].[Na+]InChIKey: HKHYOKBQJILTEI-UHFFFAOYSA-MInChI: InChI=1S/C19H14O5S.Na/c20-15-9-5-13(6-10-15)19(14-7-11-16(21)12-8-14)17-3-1-2-4-18(17)25(22,23)24-19;/h1-12,20-21H;/q;+1/p-1Synonyms: Phenol Red sodium salt|34487-61-1|Phenolsulfonephthalein sodium salt|Sodium 4-(3-(4-hydroxyphenyl)-1,1-dioxido-3H-ben...

