Catalog Number:
AG003L2M
Chemical Name:
4-Chlorobenzonitrile-2,5-diboronic acid neopentyl glycol ester
CAS Number:
1072944-28-5
Molecular Formula:
C17H22B2ClNO4
Molecular Weight:
361.4359
MDL Number:
MFCD09878542
IUPAC Name:
4-chloro-2,5-bis(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile
InChI:
InChI=1S/C17H22B2ClNO4/c1-16(2)8-22-18(23-9-16)13-6-15(20)14(5-12(13)7-21)19-24-10-17(3,4)11-25-19/h5-6H,8-11H2,1-4H3
InChI Key:
QJVLPNSCIQJOBO-UHFFFAOYSA-N
SMILES:
N#Cc1cc(B2OCC(CO2)(C)C)c(cc1B1OCC(CO1)(C)C)Cl
