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57583-74-1 | 3-methyl-2-[[p-(N-methylanilino)phenyl]azo]thiazolium methyl sulphate
CAS No: 57583-74-1 Catalog No: AG00F184 MDL No:
Product Description
Catalog Number:
AG00F184
Chemical Name:
3-methyl-2-[[p-(N-methylanilino)phenyl]azo]thiazolium methyl sulphate
CAS Number:
57583-74-1
IUPAC Name:
N-methyl-4-[(3-methyl-1,3-thiazol-3-ium-2-yl)diazenyl]-N-phenylaniline;methyl sulfate
InChI:
InChI=1S/C17H17N4S.CH4O4S/c1-20-12-13-22-17(20)19-18-14-8-10-16(11-9-14)21(2)15-6-4-3-5-7-15;1-5-6(2,3)4/h3-13H,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
InChI Key:
DUOFITVAUAHUEE-UHFFFAOYSA-M
EC Number:
260-834-8
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.093g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
420.502g/mol
Monoisotopic Mass:
420.093g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
135A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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