200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 328090-25-1
328090-25-1 | 1-Ethyl-3-methyl-1H-imidazol-3-ium 4-methylbenzenesulfonate
CAS No: 328090-25-1 Catalog No: AG003B1Q MDL No:MFCD03788929
Product Description
Catalog Number:
AG003B1Q
Chemical Name:
1-Ethyl-3-methyl-1H-imidazol-3-ium 4-methylbenzenesulfonate
CAS Number:
328090-25-1
Molecular Formula:
C13H18N2O3S
Molecular Weight:
282.3586
MDL Number:
MFCD03788929
IUPAC Name:
1-ethyl-3-methylimidazol-3-ium;4-methylbenzenesulfonate
InChI:
InChI=1S/C7H8O3S.C6H11N2/c1-6-2-4-7(5-3-6)11(8,9)10;1-3-8-5-4-7(2)6-8/h2-5H,1H3,(H,8,9,10);4-6H,3H2,1-2H3/q;+1/p-1
InChI Key:
HXMUPILCYSJMLQ-UHFFFAOYSA-M
SMILES:
Cc1ccc(cc1)S(=O)(=O)[O-].CCn1cc[n+](c1)C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.104g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.358g/mol
Monoisotopic Mass:
282.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.