Cas no 29487-13-6 (Pyridinium,3-(acetyloxy)-1-methyl-, iodide (1:1))
29487-13-6 structure
Product Name:Pyridinium,3-(acetyloxy)-1-methyl-, iodide (1:1)
CAS No:29487-13-6
MF:C8H10INO2
MW:279.074974536896
CID:262076
PubChem ID:207255
Update Time:2025-04-19
Pyridinium,3-(acetyloxy)-1-methyl-, iodide (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Pyridinium,3-(acetyloxy)-1-methyl-, iodide (1:1)
- Pyridinium, 3-hydroxy-1-methyl-, iodide, acetate
- 3-Acetyloxy-1-methylpyridinium iodide
- 3-(ACETYLOXY)-1-METHYLPYRIDIN-1-IUM IODIDE
- 29487-13-6
- Pyridinium, 3-acetyloxy-1-methyl-, iodide
- DTXSID70952002
-
- Inchi： 1S/C8H10NO2.HI/c1-7(10)11-8-4-3-5-9(2)6-8;/h3-6H,1-2H3;1H/q+1;/p-1
- InChI Key： GOZOZZSAAKJVHO-UHFFFAOYSA-M
- SMILES： [I-].O(C(C)=O)C1=CC=C[N+](C)=C1
Computed Properties
- Exact Mass: 268.8969
- Monoisotopic Mass: 278.97563g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 147
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 30.2?2
Experimental Properties
- PSA: 30.18
Pyridinium,3-(acetyloxy)-1-methyl-, iodide (1:1) Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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