Benzo[b]thiophene-5-carbonitrile


Chemical Name: Benzo[b]thiophene-5-carbonitrile
CAS Number: 2060-63-1
Product Number: AG002AGW(AGN-PC-0KL7JF)
Synonyms:
MDL No:
Molecular Formula: C9H5NS
Molecular Weight: 159.2077

Identification/Properties


Computed Properties
Molecular Weight:
159.206g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
159.014g/mol
Monoisotopic Mass:
159.014g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
193
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


NMR Spectrum


Other Analytical Data


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