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Home > Boronic Acids > 1029654-27-0
1029654-27-0 | (2-Methoxy-5-methylpyridin-3-yl);boronic acid
CAS No: 1029654-27-0 Catalog No: AG007YC0 MDL No:MFCD07437974
Product Description
Catalog Number:
AG007YC0
Chemical Name:
(2-Methoxy-5-methylpyridin-3-yl);boronic acid
CAS Number:
1029654-27-0
Molecular Formula:
C7H10BNO3
Molecular Weight:
166.9702
MDL Number:
MFCD07437974
IUPAC Name:
(2-methoxy-5-methylpyridin-3-yl)boronic acid
InChI:
InChI=1S/C7H10BNO3/c1-5-3-6(8(10)11)7(12-2)9-4-5/h3-4,10-11H,1-2H3
InChI Key:
WIIYALHHVMIETQ-UHFFFAOYSA-N
SMILES:
COc1ncc(cc1B(O)O)C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.971g/mol
Monoisotopic Mass:
167.075g/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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