57320-20-4
1H-BENZIMIDAZOLE-2-ACETONITRILE,5,6-DIMETHYL-
Name1H-BENZIMIDAZOLE-2-ACETONITRILE,5,6-DIMETHYL-
1Identification
【Name】
1H-BENZIMIDAZOLE-2-ACETONITRILE,5,6-DIMETHYL-
【CAS】
【MDL】
MFCD02194855
【English Synonyms】
【Formula】
C11 H11 N3
【MolWeight】
185.229
【Inchi】
InChI=1S/C11H11N3/c1-7-5-9-10(6-8(7)2)14-11(13-9)3-4-12/h5-6H,3H2,1-2H3,(H,13,14)
【InChIKey】
InChIKey=QGDFKNJDGNFRKB-UHFFFAOYSA-N
【SMILES】
Cc1cc2c(cc1C)nc([nH]2)CC#N
【MOL File】
1H-BENZIMIDAZOLE-2-A….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-BENZIMIDAZOLE-2-ACETONITRILE,5,6-DIMETHYL-.cml