Phenolphthalein

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Systematic / IUPAC Name: 3,3-Bis(4-hydroxyphenyl)-2-benzofuran-1(3H)-one

ID: Reference1787

Other Names: 3,3-Bis(4-hydroxyphenyl)phthalide;
Dihydroxyphthalophenone;
1(3H)-Isobenzofuranone, 3,3-bis(4-hydroxyphenyl)-;
3,3-Bis(p-hydroxyphenyl)phthalide;
Phthalide 3,3,-bis(p-hydroxyphenyl)- ; more

Formula: C20H14O4

Class: Therapeutics/Prescription Drugs

Spectral Data

Phenolphthalein mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 4
No. of Spectra 366
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/1/2014 2:41:52 PM
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Identificators

InChI 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/h1-12,21-22H
InChI Key KJFMBFZCATUALV-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O
CAS 77098
Splash
Other Names 3,3-Bis(4-hydroxyphenyl)phthalide;
Dihydroxyphthalophenone;
1(3H)-Isobenzofuranone, 3,3-bis(4-hydroxyphenyl)-;
3,3-Bis(p-hydroxyphenyl)phthalide;
Phthalide 3,3,-bis(p-hydroxyphenyl)-;
3,3-Bis(4-hydroxyphenyl)isobenzofuran-1(3H)-one;
3,3-Bis(4-hydroxyphenyl)-3-hydroisobenzofuran-1-one;
Phthalimetten;
Chocolax;
Espotabs;
Phenolax;
Purgophen;
Koprol;
Laxogen;
Trilax;
Purga;
Lilo;
Correctol;
Medilax;
Phthalin;
Agoral;
Purgen;
Colax;
Laxin;
Femilax;
Evac-Q-kit;
Evac-U-gen;
Alophen;
Doxidan;
Laxcaps;
Doxan;
Modane +;
Laxettes;
Phenophthalein;
Figsen

In Other Databases

ChemSpider 4600
ChemIDPlus 000077098; 000518514; 067874866; 089066784
ChEMBL CHEMBL63857
Wikipedia Phenolphthalein
KEGG C14286; D05456
PubChem 4764