N-(2-cyanoethyl)-4-(1,3,2-dioxaborinan-2-yl)benzamide


Chemical Name: N-(2-cyanoethyl)-4-(1,3,2-dioxaborinan-2-yl)benzamide
CAS Number: 1073372-08-3
Product Number: AG003S96(AGN-PC-07XTZI)
Synonyms:
MDL No:
Molecular Formula: C13H15BN2O3
Molecular Weight: 258.0808

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
258.084g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
258.118g/mol
Monoisotopic Mass:
258.118g/mol
Topological Polar Surface Area:
71.4A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
341
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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