(3-chloranylpyridin-4-yl)boronic acid pentahydrate

Systemtic Name: (3-chloranylpyridin-4-yl)boronic acid pentahydrate Openeye Name: (3-chloro-4-pyridyl)boronic acid pentahydrate CAS Name: (3-chloro-4-pyridinyl)boronic acid pentahydrate IUPAC Name: (3-chloropyridin-4-yl)boronic acid pentahydrate Traditional Name: (3-chloro-4-pyridyl)boronic acid pentahydrate Formula: C5H15BClNO7 MolecularWeight: 247.4391

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C=NC=C1)Cl)(O)O.O.O.O.O.O

Isomeric SMILES

B(C1=C(C=NC=C1)Cl)(O)O.O.O.O.O.O

InChI

InChI=1S/C5H5BClNO2.5H2O/c7-5-3-8-2-1-4(5)6(9)10;;;;;/h1-3,9-10H;5*1H2