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Home > Boronic Acids > 1029654-26-9
1029654-26-9 | (2-Methoxy-6-phenylpyridin-3-yl);boronic acid
CAS No: 1029654-26-9 Catalog No: AG003BNO MDL No:MFCD07437978
Product Description
Catalog Number:
AG003BNO
Chemical Name:
(2-Methoxy-6-phenylpyridin-3-yl);boronic acid
CAS Number:
1029654-26-9
Molecular Formula:
C12H12BNO3
Molecular Weight:
229.0396
MDL Number:
MFCD07437978
IUPAC Name:
(2-methoxy-6-phenylpyridin-3-yl)boronic acid
InChI:
InChI=1S/C12H12BNO3/c1-17-12-10(13(15)16)7-8-11(14-12)9-5-3-2-4-6-9/h2-8,15-16H,1H3
InChI Key:
QKCHRZYPRDYABC-UHFFFAOYSA-N
SMILES:
COc1nc(ccc1B(O)O)c1ccccc1
Properties
Complexity:
234
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:
3
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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