CAS 2411-89-4: o-Cresolphthalein complexone
Description:o-Cresolphthalein complexone, with the CAS number 2411-89-4, is a chemical compound commonly used as a chelating agent in analytical chemistry. It is particularly effective in complexing metal ions, making it valuable in titrations and colorimetric assays. The compound exhibits a distinct color change when it binds to certain metal ions, such as calcium and magnesium, which allows for visual detection and quantification. o-Cresolphthalein complexone is typically soluble in organic solvents and has a moderate solubility in water, depending on the pH of the solution. Its structure features a phenolic group, which contributes to its ability to form stable complexes with metal ions. This property makes it useful in various applications, including water hardness testing and in the determination of metal concentrations in environmental samples. Additionally, it is important to handle this compound with care, as it may pose health risks if ingested or inhaled, and appropriate safety measures should be taken during its use.
Formula:C32H32N2O12
InChI:InChI=1S/C32H32N2O12/c1-17-7-21(9-19(29(17)43)11-33(13-25(35)36)14-26(37)38)32(24-6-4-3-5-23(24)31(45)46-32)22-8-18(2)30(44)20(10-22)12-34(15-27(39)40)16-28(41)42/h3-10,43-44H,11-16H2,1-2H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42)
InChI key:InChIKey=IYZPEGVSBUNMBE-UHFFFAOYSA-N
SMILES:O=C(O)CN(CC(=O)O)CC=1C=C(C=C(C1O)C)C2(OC(=O)C=3C=CC=CC32)C=4C=C(C(O)=C(C4)CN(CC(=O)O)CC(=O)O)C
- Synonyms:
- 1,3-Dihydro-3-Oxoisobenzofuran-1-Ylidenebis(6-Hydroxy-5-Methyl-M-Phenylenemethylenenitrilo)Tetra-Acetic Acid
- 2,2',2'',2'''-{(3-Oxo-1,3-Dihydro-2-Benzofuran-1,1-Diyl)Bis[(6-Hydroxy-2,5-Dimethylbenzene-3,1-Diyl)Methanediylnitrilo]}Tetraacetic Acid
- 2,2',2'',2'''-{(3-Oxo-1,3-Dihydro-2-Benzofuran-1,1-Diyl)Bis[(6-Hydroxy-5-Methylbenzene-3,1-Diyl)Methanediylnitrilo]}Tetraacetic Acid
- 2,2'-[(3-Oxo-1,3-Dihydro-2-Benzofuran-1,1-Diyl)Bis{(6-Hydroxy-5-Methylbenzene-3,1-Diyl)Methanediyl[(Carboxymethyl)Imino]}]Diacetate (Non-Preferred Name)
- 2-[[5-[1-[3-[[Carboxylatomethyl(carboxymethyl)azaniumyl]methyl]-4-hydroxy-5-methylphenyl]-3-oxo-2-benzofuran-1-yl]-2-hydroxy-3-methylphenyl]methyl-(carboxymethyl)azaniumyl]acetate
- 3,3′-Bis[N,N-bis(carboxymethyl)aminomethyl]-o-cresolphthalein
- 3,3′-Bis[N,N-di(carboxymethyl)aminomethyl]-o-cresolphthalein
- Cresolphthalein complexon
- Cresolphthalexon
- Glycine, N,N′-[(3-oxo-1(3H)-isobenzofuranylidene)bis[(6-hydroxy-5-methyl-3,1-phenylene)methylene]]bis[N-(carboxymethyl)-
- See more synonyms
- N,N′-[(3-Oxo-1(3H)-isobenzofuranylidene)bis[(6-hydroxy-5-methyl-3,1-phenylene)methylene]]bis[N-(carboxymethyl)glycine]
- NSC 298195
- Phenolphthalein, 3′,3′′-bis[[bis(carboxymethyl)amino]methyl]-5′,5′′-dimethyl-
- Phthalein Complexon
- Phthalein Purple
- Phthalein complexone
- o-Cresolphthalein complexon
- o-Cresolphthalexon
- o-Cresolphthalexone
- o-Cresolphthalexon~Phthalein complexone