4-(1-Cyanocyclopropyl)phenylboronic acid


Chemical Name: 4-(1-Cyanocyclopropyl)phenylboronic acid
CAS Number: 1217501-00-2
Product Number: AG0015RO(AGN-PC-0WA8ZY)
Synonyms:
MDL No:
Molecular Formula: C10H10BNO2
Molecular Weight: 187.0029

Identification/Properties


Computed Properties
Molecular Weight:
187.005g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
187.08g/mol
Monoisotopic Mass:
187.08g/mol
Topological Polar Surface Area:
64.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
259
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#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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