Cas no 333452-16-7 (6-Quinoxalinol,7-fluoro-)
6-Quinoxalinol,7-fluoro- structure
Product Name:6-Quinoxalinol,7-fluoro-
CAS No:333452-16-7
MF:C8H5FN2O
MW:164.136504888535
CID:301844
PubChem ID:5294137
Update Time:2025-04-19
6-Quinoxalinol,7-fluoro- Chemical and Physical Properties
Names and Identifiers
-
- 6-Quinoxalinol,7-fluoro-
- 6-Quinoxalinol,7-fluoro-(9CI)
- CCG-321559
- 7-Fluoro-6-quinoxalinol
- 333452-16-7
- AKOS005597705
- DTXSID501313742
-
- Inchi： 1S/C8H5FN2O/c9-5-3-6-7(4-8(5)12)11-2-1-10-6/h1-4,12H
- InChI Key： DUPMUKHESPJWNS-UHFFFAOYSA-N
- SMILES： FC1C(=CC2C(C=1)=NC=CN=2)O
Computed Properties
- Exact Mass: 164.03865
- Monoisotopic Mass: 164.039
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 363
- 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: 1
- Topological Polar Surface Area: 46?2
Experimental Properties
- PSA: 46.01
6-Quinoxalinol,7-fluoro- Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
-
Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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