200,000+ products from a single source!
sales@angenechem.com
70066-45-4 | 1-ETHYL-2-(5-(1-ETHYL-1,3-BENZTHIAZOLINE-2-YLIDEN)-HEPTA-1,3,5-TRIEN-1-YL)-1,3-BENZTHIAZOLIUM CHLORIDE
CAS No: 70066-45-4 Catalog No: AG00FCW2 MDL No:
Product Description
Catalog Number:
AG00FCW2
Chemical Name:
1-ETHYL-2-(5-(1-ETHYL-1,3-BENZTHIAZOLINE-2-YLIDEN)-HEPTA-1,3,5-TRIEN-1-YL)-1,3-BENZTHIAZOLIUM CHLORIDE
CAS Number:
70066-45-4
IUPAC Name:
(2E)-3-ethyl-2-[(2E,4E,6E)-7-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)hepta-2,4,6-trienylidene]-1,3-benzothiazole;chloride
InChI:
InChI=1S/C25H25N2S2.ClH/c1-3-26-20-14-10-12-16-22(20)28-24(26)18-8-6-5-7-9-19-25-27(4-2)21-15-11-13-17-23(21)29-25;/h5-19H,3-4H2,1-2H3;1H/q+1;/p-1
InChI Key:
PIUPKWQLNMRQHR-UHFFFAOYSA-M
Properties
Complexity:
601
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
4
Exact Mass:
452.115g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
453.059g/mol
Monoisotopic Mass:
452.115g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.