Cas no 879133-16-1 (Pyridine, 4-chloro-2,3,6-trimethyl-, 1-oxide)
879133-16-1 structure
Product Name:Pyridine, 4-chloro-2,3,6-trimethyl-, 1-oxide
CAS No:879133-16-1
MF:C8H10ClNO
MW:171.624101161957
CID:650701
PubChem ID:71411805
Update Time:2025-04-19
Pyridine, 4-chloro-2,3,6-trimethyl-, 1-oxide Chemical and Physical Properties
Names and Identifiers
-
- Pyridine, 4-chloro-2,3,6-trimethyl-, 1-oxide
- 4-chloro-2,3,6-trimethyl-1-oxidopyridin-1-ium
- 879133-16-1
- 4-Chloro-2,3,6-trimethyl-1-oxo-1lambda~5~-pyridine
- DTXSID00831391
-
- Inchi： 1S/C8H10ClNO/c1-5-4-8(9)6(2)7(3)10(5)11/h4H,1-3H3
- InChI Key： UXWDZLARNQBNFX-UHFFFAOYSA-N
- SMILES： ClC1C=C(C)[N+](=C(C)C=1C)[O-]
Computed Properties
- Exact Mass: 171.0450916g/mol
- Monoisotopic Mass: 171.0450916g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 142
- 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: 1.7
- Topological Polar Surface Area: 25.5?2
Pyridine, 4-chloro-2,3,6-trimethyl-, 1-oxide Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
879133-16-1 (Pyridine, 4-chloro-2,3,6-trimethyl-, 1-oxide) Related Products
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