2-Cyclopropylaminopyrimidine-5-boronic acid, pinacol ester


Chemical Name: 2-Cyclopropylaminopyrimidine-5-boronic acid, pinacol ester
CAS Number: 1218789-33-3
Product Number: AG00166K(AGN-PC-0WA6L9)
Synonyms:
MDL No:
Molecular Formula: C13H20BN3O2
Molecular Weight: 261.1278

Identification/Properties


Computed Properties
Molecular Weight:
261.132g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
261.165g/mol
Monoisotopic Mass:
261.165g/mol
Topological Polar Surface Area:
56.3A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
323
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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