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Xylenol Orange indicator - indicator, high purity , CAS No.1611-35-4
Basic Description
Synonyms | Xylenol orange|1611-35-4|m-Cresolphthalexon S|o-Cresolphthalexon S|S2VDY878QD|NSC324982|NSC-324982|2-[[5-[3-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-5-methylphenyl]-1,1-dioxo-2,1lambda6-benzoxathiol-3-yl]-2-hydroxy-3-methylphenyl]methyl-(carboxymeth |
Specifications & Purity | indicator |
Storage Temp | Argon charged |
Shipped In | Normal |
Grade | indicator |
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Names and Identifiers
IUPAC Name | 2-[[5-[3-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-5-methylphenyl]-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]-2-hydroxy-3-methylphenyl]methyl-(carboxymethyl)amino]acetic acid |
INCHI | InChI=1S/C31H32N2O13S/c1-17-7-21(9-19(29(17)42)11-32(13-25(34)35)14-26(36)37)31(23-5-3-4-6-24(23)47(44,45)46-31)22-8-18(2)30(43)20(10-22)12-33(15-27(38)39)16-28(40)41/h3-10,42-43H,11-16H2,1-2H3,(H,34,35)(H,36,37)(H,38,39)(H,40,41) |
InChi Key | ORZHVTYKPFFVMG-UHFFFAOYSA-N |
Canonical SMILES | CC1=CC(=CC(=C1O)CN(CC(=O)O)CC(=O)O)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4)C)O)CN(CC(=O)O)CC(=O)O |
Isomeric SMILES | CC1=CC(=CC(=C1O)CN(CC(=O)O)CC(=O)O)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4)C)O)CN(CC(=O)O)CC(=O)O |
Alternate CAS | 1202864-39-8 |
PubChem CID | 73041 |
Molecular Weight | 716.62 |
Reaxy-Rn | 1067958 |
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Chemical and Physical Properties
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