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| Name |
(E)-8-Hydroxy-2-[2-(3,4,5-trihydroxyphenyl)ethenyl]-7-quinolinecarboxylic acid sodium salt |
EINECS | N/A |
| CAS No. | 210890-96-3 | Density | N/A |
| PSA | 133.68000 | LogP | 1.89870 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C18H12NNaO6 | Boiling Point | 538.7 °C at 760 mmHg |
| Molecular Weight | 361.28075 [g/mol] | Flash Point | 279.6 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
7-Quinolinecarboxylic acid, 8-hydroxy-2-[(1E)-2-(3,4,5-trihydroxyphenyl)ethenyl]-;7-Quinolinecarboxylic acid, 8-hydroxy-2-((1E)-2-(3,4,5-trihydroxyphenyl)ethenyl)-;(2E)-2-[2-(3,5-dihydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-8-hydroxy-1H-quinoline-7-carboxylic acid;Styrylquinoline der.;sodium (2E)-2-[2-(3,5-dihydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-8-hydroxy-1H-quinoline-7-carboxylate; |
(E)-8-Hydroxy-2-[2-(3,4,5-trihydroxyphenyl)ethenyl]-7-quinolinecarboxylic acid sodium salt Specification
The (E)-8-Hydroxy-2-[2-(3,4,5-trihydroxyphenyl)ethenyl]-7-quinolinecarboxylic acid sodium salt, its cas register number is 210890-96-3. It also can be called as 7-Quinolinecarboxylic acid, 8-hydroxy-2-[(1E)-2-(3,4,5-trihydroxyphenyl)ethenyl]- and the IUPAC name about this chemical is sodium (2E)-2-[2-(3,5-dihydroxy-4-oxocyclohexa-2, 5-dien-1-ylidene)ethylidene]-8-hydroxy-1H-quinoline-7-carboxylate.
Physical properties about (E)-8-Hydroxy-2-[2-(3,4,5-trihydroxyphenyl)ethenyl]-7-quinolinecarboxylic acid sodium salt are: (1)#H bond acceptors: 7; (2)#H bond donors: 5; (3)#Freely Rotating Bonds: 5; (4)Polar Surface Area: 85.3Å2; (5)Enthalpy of Vaporization: 85.88 kJ/mol; (6)Vapour Pressure: 1.94E-12 mmHg at 25°C
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C2C=C(C(=O)C(=C2)O)O)NC3=C1C=CC(=C3O)C(=O)[O-].[Na+]
(2)Isomeric SMILES: C1=C/C(=C\C=C2C=C(C(=O)C(=C2)O)O)/NC3=C1C=CC(=C3O)C(=O)[O-].[Na+]
(3)InChI: InChI=1S/C18H13NO6.Na/c20-13-7-9(8-14(21)17(13)23)1-4-11-5-2-10-3-6-12(18(24)25)16(22)15(10)19-11;/h1-8,19-22H,(H,24,25);/q;+1/p-1/b11-4+;
(4)InChIKey: WUSLSXRTSOKOAO-SODSUQDMSA-M
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