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Home > Boronic Acids > 1141888-94-9
1141888-94-9 | Boronic acid, B-[1-(2-pyridinylmethyl)-1H-pyrazol-4-yl]-
CAS No: 1141888-94-9 Catalog No: AG000AQY MDL No:
Product Description
Catalog Number:
AG000AQY
Chemical Name:
Boronic acid, B-[1-(2-pyridinylmethyl)-1H-pyrazol-4-yl]-
CAS Number:
1141888-94-9
Molecular Formula:
C9H10BN3O2
Molecular Weight:
203.0056
IUPAC Name:
[1-(pyridin-2-ylmethyl)pyrazol-4-yl]boronic acid
InChI:
InChI=1S/C9H10BN3O2/c14-10(15)8-5-12-13(6-8)7-9-3-1-2-4-11-9/h1-6,14-15H,7H2
InChI Key:
UDONZSQKNUXPTD-UHFFFAOYSA-N
SMILES:
OB(c1cnn(c1)Cc1ccccn1)O
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.087g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
203.008g/mol
Monoisotopic Mass:
203.087g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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