Cas no 88284-19-9 (3-Quinolinecarboxylic acid, 2-(4-methoxyphenoxy)-)
88284-19-9 structure
Product Name:3-Quinolinecarboxylic acid, 2-(4-methoxyphenoxy)-
CAS No:88284-19-9
MF:C17H13NO4
MW:295.289424657822
CID:638789
PubChem ID:71409465
Update Time:2025-04-19
3-Quinolinecarboxylic acid, 2-(4-methoxyphenoxy)- Chemical and Physical Properties
Names and Identifiers
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- 3-Quinolinecarboxylic acid, 2-(4-methoxyphenoxy)-
- 2-(4-methoxyphenoxy)quinoline-3-carboxylic acid
- 88284-19-9
- DTXSID00829213
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- Inchi： 1S/C17H13NO4/c1-21-12-6-8-13(9-7-12)22-16-14(17(19)20)10-11-4-2-3-5-15(11)18-16/h2-10H,1H3,(H,19,20)
- InChI Key： PKIVPLQAARYGQZ-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1)OC)C1=C(C(=O)O)C=C2C=CC=CC2=N1
Computed Properties
- Exact Mass: 295.08445790g/mol
- Monoisotopic Mass: 295.08445790g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 381
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 68.6?2
3-Quinolinecarboxylic acid, 2-(4-methoxyphenoxy)- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
88284-19-9 (3-Quinolinecarboxylic acid, 2-(4-methoxyphenoxy)-) Related Products
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