Cas no 33718-17-1 (Pyridinium,1,2,4-trimethyl-)
Pyridinium,1,2,4-trimethyl- structure
Product Name:Pyridinium,1,2,4-trimethyl-
Pyridinium,1,2,4-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Pyridinium,1,2,4-trimethyl-
- 1,2,4-trimethylpyridin-1-ium
- 1,2,4-Trimethylpyridinium
- DTXSID00187401
- 33718-17-1
- Pyridinium, 1,2,4-trimethyl-
- SCHEMBL2297527
-
- Inchi： 1S/C8H12N/c1-7-4-5-9(3)8(2)6-7/h4-6H,1-3H3/q+1
- InChI Key： PIVWQNJJTJZBMY-UHFFFAOYSA-N
- SMILES： [N+]1(C)C=CC(C)=CC=1C
Computed Properties
- Exact Mass: 122.09706
- Monoisotopic Mass: 122.096974387g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 90.6
- 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: 3.9?2
Experimental Properties
- PSA: 3.88
Pyridinium,1,2,4-trimethyl- Related Literature
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1. Spontaneous resolution of an axially dissymmetric 3-carbamoylpyridinium iodide; intrinsic discrimination between the enantiomeric forms by the introduction of a second chiral elementLoek A. M. Bastiaansen,Jan A. Kanters,Fred H. van der Steen,John A. C. de Graaf,Henk M. Buck J. Chem. Soc. Chem. Commun. 1986 536
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2. The influence of chirality in the amide side chain on the carbonyl orientation in rotational isomers of 3-carbamoylpyridinium halidesLoek A. M. Bastiaansen,Ton J. M. Vermeulen,Henk M. Buck,Wilberth J. J. Smeets,Jan A. Kanters,Anthony L. Spek J. Chem. Soc. Chem. Commun. 1988 230
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Xiao Xie,Aurélie Renvoisé,Anton Granzhan,Marie-Paule Teulade-Fichou New J. Chem. 2015 39 5931
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G. V. Boyd,A. W. Ellis,M. D. Harms J. Chem. Soc. C 1970 800
33718-17-1 (Pyridinium,1,2,4-trimethyl-) Related Products
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