200,000+ products from a single source!
sales@angenechem.com
40265-71-2 | Benzothiazolium, 2,3-dimethyl-
CAS No: 40265-71-2 Catalog No: AG0073S4 MDL No:
Product Description
Catalog Number:
AG0073S4
Chemical Name:
Benzothiazolium, 2,3-dimethyl-
CAS Number:
40265-71-2
Molecular Formula:
C9H10NS+
Molecular Weight:
164.2474
IUPAC Name:
2,3-dimethyl-1,3-benzothiazol-3-ium
InChI:
InChI=1S/C9H10NS/c1-7-10(2)8-5-3-4-6-9(8)11-7/h3-6H,1-2H3/q+1
InChI Key:
QBQDROYKEQDPRX-UHFFFAOYSA-N
SMILES:
C[n+]1c(C)sc2c1cccc2
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.053g/mol
Formal Charge:
1
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.246g/mol
Monoisotopic Mass:
164.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.