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97453-89-9 | 4,5-DIPHENYL-3-ETHYL-2-METHYLTHIAZOLIUM IODIDE
CAS No: 97453-89-9 Catalog No: AG00H8XT MDL No:
Product Description
Catalog Number:
AG00H8XT
Chemical Name:
4,5-DIPHENYL-3-ETHYL-2-METHYLTHIAZOLIUM IODIDE
CAS Number:
97453-89-9
Molecular Formula:
C18H18INS
Molecular Weight:
407.3117
IUPAC Name:
3-ethyl-2-methyl-4,5-diphenyl-1,3-thiazol-3-ium;iodide
InChI:
InChI=1S/C18H18NS.HI/c1-3-19-14(2)20-18(16-12-8-5-9-13-16)17(19)15-10-6-4-7-11-15;/h4-13H,3H2,1-2H3;1H/q+1;/p-1
InChI Key:
SBQUDTMUNCFHNJ-UHFFFAOYSA-M
SMILES:
CC[n+]1c(C)sc(c1c1ccccc1)c1ccccc1.[I-]
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
407.02g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
407.313g/mol
Monoisotopic Mass:
407.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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