2-Pyridinamine, 5-(2-benzothiazolyl)-


Chemical Name: 2-Pyridinamine, 5-(2-benzothiazolyl)-
CAS Number: 178804-21-2
Product Number: AG00ABW5(AGN-PC-0LIP9E)
Synonyms:
MDL No:
Molecular Formula: C12H9N3S
Molecular Weight: 227.2850

Identification/Properties


Computed Properties
Molecular Weight:
227.285g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
227.052g/mol
Monoisotopic Mass:
227.052g/mol
Topological Polar Surface Area:
80A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
248
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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