4-(2-Cyanovinyl)phenylboronic acid


Chemical Name: 4-(2-Cyanovinyl)phenylboronic acid
CAS Number: 1072946-14-5
Product Number: AG008524(AGN-PC-0WA935)
Synonyms:
MDL No:
Molecular Formula: C9H8BNO2
Molecular Weight: 172.9763

Identification/Properties


Computed Properties
Molecular Weight:
172.978g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
173.065g/mol
Monoisotopic Mass:
173.065g/mol
Topological Polar Surface Area:
64.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
223
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


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

NMR Spectrum


Other Analytical Data


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