Cas no 14494-69-0 (Zincate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen, (T-4)- (9CI))
14494-69-0 structure
Product Name:Zincate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen, (T-4)- (9CI)
CAS No:14494-69-0
MF:C18H12N2O8S2Zn
MW:513.835478782654
CID:166610
PubChem ID:203457
Update Time:2025-04-19
Zincate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen, (T-4)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Zincate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen, (T-4)- (9CI)
- Zinc(II), bis(5-sulfo-8-quinolinolato-N(sup 1),O(sup 8))-
- NSC 166687
- Zinc, bis(5-sulfo-8-quinolinolato)-
- Zincate(2-), bis(8-hydroxy-5-quinolinesulfonato(2-)-N1,O8)-, dihydrogen, (T-4)-
- 14494-69-0
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- Inchi: 1S/2C9H7NO4S.Zn/c2*11-7-3-4-8(15(12,13)14)6-2-1-5-10-9(6)7;/h2*1-5,11H,(H,12,13,14);/q;;+2/p-2
- InChI Key: RRMHYLZMKFYSRT-UHFFFAOYSA-L
- SMILES: [Zn+2].S(C1=CC=C(C2C1=CC=CN=2)[O-])(=O)(=O)[O-].S(C1=CC=C(C2C1=CC=CN=2)[O-])(=O)(=O)[O-].[H+].[H+]
Computed Properties
- Exact Mass: 511.93266
- Monoisotopic Mass: 511.932649g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 31
- Rotatable Bond Count: 0
- Complexity: 310
- Covalently-Bonded Unit Count: 5
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 203?2
Experimental Properties
- PSA: 180.64
Zincate(2-),bis[8-(hydroxy-kO)-5-quinolinesulfonato(2-)-kN1]-, dihydrogen, (T-4)- (9CI) Related Literature
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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