Cas no 628284-99-1 (4-Quinolinol,6-ethyl-3-nitro-(9CI))
628284-99-1 structure
Product Name:4-Quinolinol,6-ethyl-3-nitro-(9CI)
CAS No:628284-99-1
MF:C11H10N2O3
MW:218.20870256424
CID:958023
PubChem ID:45095309
Update Time:2025-04-19
4-Quinolinol,6-ethyl-3-nitro-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 4-Quinolinol,6-ethyl-3-nitro-(9CI)
- 6-ethyl-3-nitro-1H-quinolin-4-one
- 6-Ethyl-3-nitro-quinolin-4-ol
- VPENCSHERWBWGY-UHFFFAOYSA-N
- 4-quinolinol,6-ethyl-3-nitro-
- 4-Quinolinol, 6-ethyl-3-nitro-
- SCHEMBL2246090
- DB-284006
- 628284-99-1
- 6-ethyl-3-nitroquinolin-4-ol
-
- Inchi： 1S/C11H10N2O3/c1-2-7-3-4-9-8(5-7)11(14)10(6-12-9)13(15)16/h3-6H,2H2,1H3,(H,12,14)
- InChI Key： VPENCSHERWBWGY-UHFFFAOYSA-N
- SMILES： O=C1C(=CNC2C=CC(CC)=CC=21)[N+](=O)[O-]
Computed Properties
- Exact Mass: 218.06914219g/mol
- Monoisotopic Mass: 218.06914219g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 346
- 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: 2.4
- Topological Polar Surface Area: 74.9?2
4-Quinolinol,6-ethyl-3-nitro-(9CI) Related Literature
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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