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Home > Boronic Acids > 850991-69-4
850991-69-4 | 5-Methoxypyridine-3-boronic acid
CAS No: 850991-69-4 Catalog No: AG0036E5 MDL No:MFCD03425977
Product Description
Catalog Number:
AG0036E5
Chemical Name:
5-Methoxypyridine-3-boronic acid
CAS Number:
850991-69-4
Molecular Formula:
C6H8BNO3
Molecular Weight:
152.9436
MDL Number:
MFCD03425977
IUPAC Name:
(5-methoxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C6H8BNO3/c1-11-6-2-5(7(9)10)3-8-4-6/h2-4,9-10H,1H3
InChI Key:
ISDFOFZTZUILPE-UHFFFAOYSA-N
SMILES:
COc1cncc(c1)B(O)O
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.06g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
152.944g/mol
Monoisotopic Mass:
153.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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