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Home > Boronic Acids > 1245898-82-1
1245898-82-1 | (2-(tert-butoxy)pyridin-3-yl)boronic acid
CAS No: 1245898-82-1 Catalog No: AG009IPE MDL No:MFCD26397235
Product Description
Catalog Number:
AG009IPE
Chemical Name:
(2-(tert-butoxy)pyridin-3-yl)boronic acid
CAS Number:
1245898-82-1
Molecular Formula:
C9H14BNO3
Molecular Weight:
195.0234
MDL Number:
MFCD26397235
IUPAC Name:
[2-[(2-methylpropan-2-yl)oxy]pyridin-3-yl]boronic acid
InChI:
InChI=1S/C9H14BNO3/c1-9(2,3)14-8-7(10(12)13)5-4-6-11-8/h4-6,12-13H,1-3H3
InChI Key:
HNPJPQRHQRFFOW-UHFFFAOYSA-N
SMILES:
OB(c1cccnc1OC(C)(C)C)O
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.107g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.025g/mol
Monoisotopic Mass:
195.107g/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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