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Home > Boronic Acids > 1072952-41-0
1072952-41-0 | (2-(Benzyloxy);pyridin-3-yl);boronic acid
CAS No: 1072952-41-0 Catalog No: AG003BK1 MDL No:MFCD06798264
Product Description
Catalog Number:
AG003BK1
Chemical Name:
(2-(Benzyloxy);pyridin-3-yl);boronic acid
CAS Number:
1072952-41-0
Molecular Formula:
C12H12BNO3
Molecular Weight:
229.0396
MDL Number:
MFCD06798264
IUPAC Name:
(2-phenylmethoxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C12H12BNO3/c15-13(16)11-7-4-8-14-12(11)17-9-10-5-2-1-3-6-10/h1-8,15-16H,9H2
InChI Key:
YTIGWZQYGHOXOB-UHFFFAOYSA-N
SMILES:
OB(c1cccnc1OCc1ccccc1)O
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.091g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.042g/mol
Monoisotopic Mass:
229.091g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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