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63870-40-6 | 2-(BETA-ANILINO)VINYL-3-ETHYL THIAZOLIUM IODIDE
CAS No: 63870-40-6 Catalog No: AG00EDLL MDL No:
Product Description
Catalog Number:
AG00EDLL
Chemical Name:
2-(BETA-ANILINO)VINYL-3-ETHYL THIAZOLIUM IODIDE
CAS Number:
63870-40-6
IUPAC Name:
N-[2-(3-ethyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)ethenyl]aniline;iodide
InChI:
InChI=1S/C13H16N2S.HI/c1-2-15-10-11-16-13(15)8-9-14-12-6-4-3-5-7-12;/h3-9H,2,10-11H2,1H3;1H
InChI Key:
UZMRRJAQORCIRP-UHFFFAOYSA-N
EC Number:
264-532-7
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.016g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
360.257g/mol
Monoisotopic Mass:
360.016g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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