200,000+ products from a single source!
sales@angenechem.com
1804-16-6 | Pyridinium, 1-methyl-2-[(phenylsulfonyl)methyl]-, iodide (1:1)
CAS No: 1804-16-6 Catalog No: AG0021Z4 MDL No:
Product Description
Catalog Number:
AG0021Z4
Chemical Name:
Pyridinium, 1-methyl-2-[(phenylsulfonyl)methyl]-, iodide (1:1)
CAS Number:
1804-16-6
Molecular Formula:
C13H14INO2S
Molecular Weight:
375.2252
IUPAC Name:
2-(benzenesulfonylmethyl)-1-methylpyridin-1-ium;iodide
InChI:
InChI=1S/C13H14NO2S.HI/c1-14-10-6-5-7-12(14)11-17(15,16)13-8-3-2-4-9-13;/h2-10H,11H2,1H3;1H/q+1;/p-1
InChI Key:
VXJILWJNCDILAC-UHFFFAOYSA-M
SMILES:
C[n+]1ccccc1CS(=O)(=O)c1ccccc1.[I-]
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.979g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.224g/mol
Monoisotopic Mass:
374.979g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.