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Home > Boronic Acids > 913835-98-0
913835-98-0 | (6-(Hydroxymethyl);pyridin-3-yl);boronic acid
CAS No: 913835-98-0 Catalog No: AG006BHO MDL No:MFCD09027230
Product Description
Catalog Number:
AG006BHO
Chemical Name:
(6-(Hydroxymethyl);pyridin-3-yl);boronic acid
CAS Number:
913835-98-0
Molecular Formula:
C6H8BNO3
Molecular Weight:
152.9436
MDL Number:
MFCD09027230
IUPAC Name:
[6-(hydroxymethyl)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C6H8BNO3/c9-4-6-2-1-5(3-8-6)7(10)11/h1-3,9-11H,4H2
InChI Key:
MSUQKXAJTUAESD-UHFFFAOYSA-N
SMILES:
OCc1ccc(cn1)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:
3
Isotope Atom Count:
0
Molecular Weight:
152.944g/mol
Monoisotopic Mass:
153.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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