Boronic acid, B-(2,6-difluoro-3-pyridinyl)-, hydrate (1:1)


Chemical Name: Boronic acid, B-(2,6-difluoro-3-pyridinyl)-, hydrate (1:1)
CAS Number: 1072952-27-2
Product Number: AG003BL7(AGN-PC-0786MZ)
Synonyms:
MDL No:
Molecular Formula: C5H6BF2NO3
Molecular Weight: 176.9138

Identification/Properties


Properties
BP:
416.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
176.914g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
177.041g/mol
Monoisotopic Mass:
177.041g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
138
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:
2
Compound Is Canonicalized:
Yes

Safety Information


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

NMR Spectrum


Other Analytical Data


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