Boronic acid, (4-cyanophenyl)-


Chemical Name: Boronic acid, (4-cyanophenyl)-
CAS Number: 126747-14-6
Product Number: AG000T6E(AGN-PC-088NI4)
Synonyms:
MDL No: MFCD01318968
Molecular Formula: C7H6BNO2
Molecular Weight: 146.9390

Identification/Properties


Properties
MP:
>300 °C
BP:
355.9°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
146.94g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
147.049g/mol
Monoisotopic Mass:
147.049g/mol
Topological Polar Surface Area:
64.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
167
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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