Cas no 98959-85-4 (Pyridine, 3,5-diethoxy-)
Pyridine, 3,5-diethoxy- structure
Product Name:Pyridine, 3,5-diethoxy-
CAS No:98959-85-4
MF:C9H13NO2
MW:167.205022573471
CID:802137
PubChem ID:18761967
Update Time:2025-04-19
Pyridine, 3,5-diethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Pyridine, 3,5-diethoxy-
- 3,5-DIETHOXYPYRIDINE
- 3,5-Diaethoxy-pyridin
- 3,5-diethoxy-pyridine
- Pyridine,3,5-diethoxy
- SCHEMBL3819558
- AKOS006331660
- FT-0740038
- DTXSID40596053
- 98959-85-4
-
- Inchi： 1S/C9H13NO2/c1-3-11-8-5-9(12-4-2)7-10-6-8/h5-7H,3-4H2,1-2H3
- InChI Key： KLTYMCNDQCBKKY-UHFFFAOYSA-N
- SMILES： O(CC)C1C=NC=C(C=1)OCC
Computed Properties
- Exact Mass: 167.09500
- Monoisotopic Mass: 167.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 107
- 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: 1.5
- Topological Polar Surface Area: 31.4?2
Experimental Properties
- PSA: 31.35000
- LogP: 1.87900
Pyridine, 3,5-diethoxy- Related Literature
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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