4,4-Difluorocyclohexene-1-boronic Acid Pinacol Ester


Chemical Name: 4,4-Difluorocyclohexene-1-boronic Acid Pinacol Ester
CAS Number: 1227068-84-9
Product Number: AG000J0K(AGN-PC-0WAG4M)
Synonyms:
MDL No:
Molecular Formula: C12H19BF2O2
Molecular Weight: 244.0859

Identification/Properties


Properties
BP:
233.3±50.0°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
244.089g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
244.145g/mol
Monoisotopic Mass:
244.145g/mol
Topological Polar Surface Area:
18.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
334
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:
H302-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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