Boronic acid, [4-(hexyloxy)phenyl]-


Chemical Name: Boronic acid, [4-(hexyloxy)phenyl]-
CAS Number: 121219-08-7
Product Number: AG007P49(AGN-PC-0KYJ3I)
Synonyms:
MDL No:
Molecular Formula: C12H19BO3
Molecular Weight: 222.0885

Identification/Properties


Computed Properties
Molecular Weight:
222.091g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
7
Exact Mass:
222.143g/mol
Monoisotopic Mass:
222.143g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
168
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
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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