200,000+ products from a single source!
sales@angenechem.com
21223-49-4 | Benzothiazolium, 2-(4-methoxyphenyl)-3-methyl-, iodide
CAS No: 21223-49-4 Catalog No: AG006YKF MDL No:
Product Description
Catalog Number:
AG006YKF
Chemical Name:
Benzothiazolium, 2-(4-methoxyphenyl)-3-methyl-, iodide
CAS Number:
21223-49-4
Molecular Formula:
C15H14INOS
Molecular Weight:
383.2472
IUPAC Name:
2-(4-methoxyphenyl)-3-methyl-1,3-benzothiazol-3-ium;iodide
InChI:
InChI=1S/C15H14NOS.HI/c1-16-13-5-3-4-6-14(13)18-15(16)11-7-9-12(17-2)10-8-11;/h3-10H,1-2H3;1H/q+1;/p-1
InChI Key:
SNWILRVRRRQKTD-UHFFFAOYSA-M
SMILES:
COc1ccc(cc1)c1sc2c([n+]1C)cccc2.[I-]
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.984g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
383.247g/mol
Monoisotopic Mass:
382.984g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.