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84864-69-7 | 8-Quinolinesulfonicacid, 2-(2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-, sodium salt (1:1)
CAS No: 84864-69-7 Catalog No: AG004MM5 MDL No:
Product Description
Catalog Number:
AG004MM5
Chemical Name:
8-Quinolinesulfonicacid, 2-(2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-, sodium salt (1:1)
CAS Number:
84864-69-7
Molecular Formula:
C18H10NNaO5S
Molecular Weight:
375.3305
IUPAC Name:
sodium;2-(1,3-dioxoinden-2-yl)quinoline-8-sulfonate
InChI:
InChI=1S/C18H11NO5S.Na/c20-17-11-5-1-2-6-12(11)18(21)15(17)13-9-8-10-4-3-7-14(16(10)19-13)25(22,23)24;/h1-9,15H,(H,22,23,24);/q;+1/p-1
InChI Key:
FYPFGVAVAPLSHG-UHFFFAOYSA-M
SMILES:
O=C1C(c2ccc3c(n2)c(ccc3)S(=O)(=O)[O-])C(=O)c2c1cccc2.[Na+]
EC Number:
284-393-6
UNII:
PG3M9G2PGQ
Properties
Complexity:
652
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.018g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.33g/mol
Monoisotopic Mass:
375.018g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Preparative separation of isomeric 2-(2-quinolinyl)-1H-indene-1,3(2H)-dione monosulfonic acids of the color additive D&C Yellow No. 10 (quinoline yellow) by pH-zone-refining counter-current chromatography. | Journal of chromatography. A 20010720 |
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