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Home > Boronic Acids > 1256355-50-6
1256355-50-6 | Boronic acid, B-[3-(2-pyridinylmethoxy)phenyl]-
CAS No: 1256355-50-6 Catalog No: AG000O49 MDL No:MFCD11183192
Product Description
Catalog Number:
AG000O49
Chemical Name:
Boronic acid, B-[3-(2-pyridinylmethoxy)phenyl]-
CAS Number:
1256355-50-6
Molecular Formula:
C12H12BNO3
Molecular Weight:
229.0396
MDL Number:
MFCD11183192
IUPAC Name:
[3-(pyridin-2-ylmethoxy)phenyl]boronic acid
InChI:
InChI=1S/C12H12BNO3/c15-13(16)10-4-3-6-12(8-10)17-9-11-5-1-2-7-14-11/h1-8,15-16H,9H2
InChI Key:
TYDYAVCTOHBQAL-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)OCc1ccccn1)O
Properties
Complexity:
228
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:
4
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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