[3-[(4-heptoxyphenoxy)methyl]phenyl]boronic acid


Chemical Name: [3-[(4-heptoxyphenoxy)methyl]phenyl]boronic acid
CAS Number: 870778-93-1
Product Number: AG003BQ0(AGN-PC-00UQPP)
Synonyms:
MDL No:
Molecular Formula: C20H27BO4
Molecular Weight: 342.2370

Identification/Properties


Properties
MP:
159-164°C
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
342.242g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
11
Exact Mass:
342.2g/mol
Monoisotopic Mass:
342.2g/mol
Topological Polar Surface Area:
58.9A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
332
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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