175135-31-6
2-[5-(2-BROMO-5-METHOXYPHENYL)-1,3,4-OXADIAZOL-2-YL]ANILINE
Name2-[5-(2-BROMO-5-METHOXYPHENYL)-1,3,4-OXADIAZOL-2-YL]ANILINE
1Identification
【Name】
2-[5-(2-BROMO-5-METHOXYPHENYL)-1,3,4-OXADIAZOL-2-YL]ANILINE
【CAS】
【MDL】
MFCD00052878
【English Synonyms】
【Formula】
C15 H12 Br N3 O2
【MolWeight】
346.183
【Inchi】
InChI=1S/C15H12BrN3O2/c1-20-9-6-7-12(16)11(8-9)15-19-18-14(21-15)10-4-2-3-5-13(10)17/h2-8H,17H2,1H3
【InChIKey】
InChIKey=LUEIKOBKCRYXBE-UHFFFAOYSA-N
【SMILES】
COc1ccc(c(c1)c2nnc(o2)c3ccccc3N)Br
【MOL File】
2-[5-(2-BROMO-5-METH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-[5-(2-BROMO-5-METHOXYPHENYL)-1,3,4-OXADIAZOL-2-YL]ANILINE.cml