Product Name3-BORONO-2-THIOPHENECARBOXYLIC ACID
CAS5503-74-2
Molecular FormulaC5H5BO4S
Molecular Weight171.97
InChIInChI=1S/C5H5BO4S/c7-5(8)4-3(6(9)10)1-2-11-4/h1-2,9-10H,(H,7,8)
InChIKey AJNCKPIBBSWSBY-UHFFFAOYSA-N
SmilesC1(C(O)=O)SC=CC=1B(O)O
Parameter ppm Hz
D(A) 7.78 D(B) 7.44 J(A,B) 5.0 D(C) 8.02 D(D) 8.02 GRONOWITZ,S. & BUGGE,A. ACTA CHEM.SCAND. 20, 261 (1966)
3-BORONO-2-THIOPHENECARBOXYLIC ACID(5503-74-2) 1H NMR Atlas of Related Products