[2-(trideuteriomethyl)pyrimidin-5-yl]boronic acid


Chemical Name: [2-(trideuteriomethyl)pyrimidin-5-yl]boronic acid
CAS Number: 1034924-06-5
Product Number: AG00381L(AGN-PC-07H82E)
Synonyms:
MDL No:
Molecular Formula: C5H7BN2O2
Molecular Weight: 137.9323

Identification/Properties


Computed Properties
Molecular Weight:
137.933g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
138.06g/mol
Monoisotopic Mass:
138.06g/mol
Topological Polar Surface Area:
66.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
104
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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