Catalog Number:
AG0016AM
Chemical Name:
5-Cyano-2-nitrophenylboronic acid, pinacol ester
CAS Number:
1218791-27-5
Molecular Formula:
C13H15BN2O4
Molecular Weight:
274.0802
MDL Number:
MFCD12546471
IUPAC Name:
4-nitro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
InChI:
InChI=1S/C13H15BN2O4/c1-12(2)13(3,4)20-14(19-12)10-7-9(8-15)5-6-11(10)16(17)18/h5-7H,1-4H3
InChI Key:
XGIWPDLRNUKSKD-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]