2-(1-benzothiophen-2-yl)pyridin-3-ol


Chemical Name: 2-(1-benzothiophen-2-yl)pyridin-3-ol
CAS Number: 1261973-39-0
Product Number: AG000SA0(AGN-PC-09Q03U)
Synonyms:
MDL No:
Molecular Formula: C13H9NOS
Molecular Weight: 227.2817

Identification/Properties


Computed Properties
Molecular Weight:
227.281g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
227.04g/mol
Monoisotopic Mass:
227.04g/mol
Topological Polar Surface Area:
61.4A^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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