(7-cyano-1-benzothiophen-2-yl)boronic acid


Chemical Name: (7-cyano-1-benzothiophen-2-yl)boronic acid
CAS Number: 1119899-37-4
Product Number: AG008TVK(AGN-PC-09TQJS)
Synonyms:
MDL No:
Molecular Formula: C9H6BNO2S
Molecular Weight: 203.0254

Identification/Properties


Computed Properties
Molecular Weight:
203.022g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
203.021g/mol
Monoisotopic Mass:
203.021g/mol
Topological Polar Surface Area:
92.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
265
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302+H312+H332
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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