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3065-71-2 | 3-ETHYL-2-[3-(3-ETHYL-2-THIAZOLIDINYLIDENE)-1-PROPENYL]-THIAZOLINIUM IODIDE
CAS No: 3065-71-2 Catalog No: AG00C1LE MDL No:
Product Description
Catalog Number:
AG00C1LE
Chemical Name:
3-ETHYL-2-[3-(3-ETHYL-2-THIAZOLIDINYLIDENE)-1-PROPENYL]-THIAZOLINIUM IODIDE
CAS Number:
3065-71-2
IUPAC Name:
3-ethyl-2-[3-(3-ethyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)prop-2-enylidene]-1,3-thiazolidine;iodide
InChI:
InChI=1S/C13H21N2S2.HI/c1-3-14-8-10-16-12(14)6-5-7-13-15(4-2)9-11-17-13;/h5-7H,3-4,8-11H2,1-2H3;1H/q+1;/p-1
InChI Key:
GESKGLZQRFOWRW-UHFFFAOYSA-M
EC Number:
221-316-7
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.019g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.349g/mol
Monoisotopic Mass:
396.019g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
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