Cas no 91493-45-7 (2-Propenoic acid,3-(8-hydroxy-2-quinolinyl)-)
91493-45-7 structure
Product Name:2-Propenoic acid,3-(8-hydroxy-2-quinolinyl)-
CAS No:91493-45-7
MF:C12H9NO3
MW:215.204763174057
CID:799821
PubChem ID:29943694
Update Time:2025-04-19
2-Propenoic acid,3-(8-hydroxy-2-quinolinyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,3-(8-hydroxy-2-quinolinyl)-
- 3-(8-HYDROXY-QUINOLIN-2-YL)-ACRYLIC ACID
- 3-(8-hydroxyquinolin-2-yl)prop-2-enoic acid
- 3-(8-Hydroxyquinolin-2-yl)acrylic acid
- SCHEMBL2854571
- 91493-45-7
- SCHEMBL2856921
-
- MDL： MFCD06205377
- Inchi： 1S/C12H9NO3/c14-10-3-1-2-8-4-5-9(13-12(8)10)6-7-11(15)16/h1-7,14H,(H,15,16)/b7-6+
- InChI Key： IUVXVLBCPIBXLZ-VOTSOKGWSA-N
- SMILES： OC1=CC=CC2=CC=C(/C=C/C(=O)O)N=C21
Computed Properties
- Exact Mass: 215.058
- Monoisotopic Mass: 215.058
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 290
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 70.4A^2
2-Propenoic acid,3-(8-hydroxy-2-quinolinyl)- Related Literature
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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