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40265-74-5 | 1,2-Dimethylnaphtho[1,2-d]thiazol-3-ium
CAS No: 40265-74-5 Catalog No: AG00CV1O MDL No:
Product Description
Catalog Number:
AG00CV1O
Chemical Name:
1,2-Dimethylnaphtho[1,2-d]thiazol-3-ium
CAS Number:
40265-74-5
IUPAC Name:
1,2-dimethylbenzo[e][1,3]benzothiazol-1-ium
InChI:
InChI=1S/C13H12NS/c1-9-14(2)13-11-6-4-3-5-10(11)7-8-12(13)15-9/h3-8H,1-2H3/q+1
InChI Key:
MQFVWWGIAINZAB-UHFFFAOYSA-N
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.069g/mol
Formal Charge:
1
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.306g/mol
Monoisotopic Mass:
214.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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