200,000+ products from a single source!
sales@angenechem.com
26190-44-3 | Naphtho[2,1-d]thiazolium, 3-ethyl-2-[5-(3-ethylnaphtho[2,1-d]thiazol-2(3H)-ylidene)-1,3-pentadien-1-yl]-, chloride (1:1)
CAS No: 26190-44-3 Catalog No: AG002S5A MDL No:
Product Description
Catalog Number:
AG002S5A
Chemical Name:
Naphtho[2,1-d]thiazolium, 3-ethyl-2-[5-(3-ethylnaphtho[2,1-d]thiazol-2(3H)-ylidene)-1,3-pentadien-1-yl]-, chloride (1:1)
CAS Number:
26190-44-3
Molecular Formula:
C31H27ClN2S2
Molecular Weight:
527.1425
IUPAC Name:
3-ethyl-2-[5-(3-ethylbenzo[g][1,3]benzothiazol-3-ium-2-yl)penta-2,4-dienylidene]benzo[g][1,3]benzothiazole;chloride
InChI:
InChI=1S/C31H27N2S2.ClH/c1-3-32-26-20-18-22-12-8-10-14-24(22)30(26)34-28(32)16-6-5-7-17-29-33(4-2)27-21-19-23-13-9-11-15-25(23)31(27)35-29;/h5-21H,3-4H2,1-2H3;1H/q+1;/p-1
InChI Key:
LKPSLAUZQVOSCU-UHFFFAOYSA-M
SMILES:
CC[n+]1c(C=CC=CC=c2sc3c(n2CC)ccc2c3cccc2)sc2c1ccc1c2cccc1.[Cl-]
Properties
Complexity:
757
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
526.13g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
527.141g/mol
Monoisotopic Mass:
526.13g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.