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Home > Boronic Acids > 1217501-25-1
1217501-25-1 | Boronic acid, B,B'-(2,6-dimethoxy-3,5-pyridinediyl)bis-
CAS No: 1217501-25-1 Catalog No: AG0015SF MDL No:MFCD12756421
Product Description
Catalog Number:
AG0015SF
Chemical Name:
Boronic acid, B,B'-(2,6-dimethoxy-3,5-pyridinediyl)bis-
CAS Number:
1217501-25-1
Molecular Formula:
C7H11B2NO6
Molecular Weight:
226.7873
MDL Number:
MFCD12756421
IUPAC Name:
(5-borono-2,6-dimethoxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C7H11B2NO6/c1-15-6-4(8(11)12)3-5(9(13)14)7(10-6)16-2/h3,11-14H,1-2H3
InChI Key:
GNVINSUSNLQQHZ-UHFFFAOYSA-N
SMILES:
COc1nc(OC)c(cc1B(O)O)B(O)O
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.077g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
226.786g/mol
Monoisotopic Mass:
227.077g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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