141078-99-1
4,5-BIS(4-METHYLPHENYL)-3-((4-METHYLPHENOXY)METHYL)-4H-1,2,4-TRIAZOLE
Name4,5-BIS(4-METHYLPHENYL)-3-((4-METHYLPHENOXY)METHYL)-4H-1,2,4-TRIAZOLE
1Identification
【Name】
4,5-BIS(4-METHYLPHENYL)-3-((4-METHYLPHENOXY)METHYL)-4H-1,2,4-TRIAZOLE
【CAS】
【MDL】
MFCD01678685
【English Synonyms】
【Formula】
C24 H23 N3 O
【MolWeight】
369.466
【Inchi】
InChI=1S/C24H23N3O/c1-17-4-10-20(11-5-17)24-26-25-23(16-28-22-14-8-19(3)9-15-22)27(24)21-12-6-18(2)7-13-21/h4-15H,16H2,1-3H3
【InChIKey】
InChIKey=QQSNXJBAOGUOOV-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)c2nnc(n2c3ccc(cc3)C)COc4ccc(cc4)C
【MOL File】
4,5-BIS(4-METHYLPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,5-BIS(4-METHYLPHENYL)-3-((4-METHYLPHENOXY)METHYL)-4H-1,2,4-TRIAZOLE.cml