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60878-87-7 | 2-(BETA-ANILINO)VINYL-3-METHYL THIAZOLIUM IODIDE
CAS No: 60878-87-7 Catalog No: AG00EDLO MDL No:
Product Description
Catalog Number:
AG00EDLO
Chemical Name:
2-(BETA-ANILINO)VINYL-3-METHYL THIAZOLIUM IODIDE
CAS Number:
60878-87-7
IUPAC Name:
N-[2-(3-methyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)ethenyl]aniline;iodide
InChI:
InChI=1S/C12H14N2S.HI/c1-14-9-10-15-12(14)7-8-13-11-5-3-2-4-6-11;/h2-8H,9-10H2,1H3;1H
InChI Key:
QXWBFLXDKHKGKY-UHFFFAOYSA-N
EC Number:
262-512-2
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
346.23g/mol
Monoisotopic Mass:
346g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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