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64415-17-4 | 2,3-DIMETHYLNAPHTHO[1,2-D]THIAZOLIUM METHYLSULFATE
CAS No: 64415-17-4 Catalog No: AG00E8TG MDL No:
Product Description
Catalog Number:
AG00E8TG
Chemical Name:
2,3-DIMETHYLNAPHTHO[1,2-D]THIAZOLIUM METHYLSULFATE
CAS Number:
64415-17-4
IUPAC Name:
1,2-dimethylbenzo[e][1,3]benzothiazol-1-ium;methyl sulfate
InChI:
InChI=1S/C13H12NS.CH4O4S/c1-9-14(2)13-11-6-4-3-5-10(11)7-8-12(13)15-9;1-5-6(2,3)4/h3-8H,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
InChI Key:
WDNJSOGMYXBSIC-UHFFFAOYSA-M
NSC Number:
119921
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.044g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.397g/mol
Monoisotopic Mass:
325.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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