106636-47-9
2-METHYL-6-(4-NITRO-PHENYL)-IMIDAZO2,1-BTHIAZOLE
Name2-METHYL-6-(4-NITRO-PHENYL)-IMIDAZO2,1-BTHIAZOLE
1Identification
【Name】
2-METHYL-6-(4-NITRO-PHENYL)-IMIDAZO2,1-BTHIAZOLE
【CAS】
【MDL】
MFCD01456279
【English Synonyms】
【Formula】
C12 H9 N3 O2 S
【MolWeight】
259.288
【Inchi】
InChI=1S/C12H9N3O2S/c1-8-6-14-7-11(13-12(14)18-8)9-2-4-10(5-3-9)15(16)17/h2-7H,1H3
【InChIKey】
InChIKey=TVNZIVGSNZNQOJ-UHFFFAOYSA-N
【SMILES】
Cc1cn2cc(nc2s1)c3ccc(cc3)[N+](=O)[O-]
【MOL File】
2-METHYL-6-(4-NITRO-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-METHYL-6-(4-NITRO-PHENYL)-IMIDAZO2,1-BTHIAZOLE.cml