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Home > Boronic Acids > 1029654-24-7
1029654-24-7 | 2-METHOXY-4-PHENYLPYRIDINE-3-BORONIC ACID
CAS No: 1029654-24-7 Catalog No: AG008SEL MDL No:MFCD07437976
Product Description
Catalog Number:
AG008SEL
Chemical Name:
2-METHOXY-4-PHENYLPYRIDINE-3-BORONIC ACID
CAS Number:
1029654-24-7
Molecular Formula:
C12H12BNO3
Molecular Weight:
229.0396
MDL Number:
MFCD07437976
IUPAC Name:
(2-methoxy-4-phenylpyridin-3-yl)boronic acid
InChI:
InChI=1S/C12H12BNO3/c1-17-12-11(13(15)16)10(7-8-14-12)9-5-3-2-4-6-9/h2-8,15-16H,1H3
InChI Key:
MUVGNTPCIFKWFL-UHFFFAOYSA-N
SMILES:
COc1nccc(c1B(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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