107572-59-8
3,5-BIS(3,4-DIMETHOXYPHENYL)-1H-1,2,4-TRIAZOLE
Name3,5-BIS(3,4-DIMETHOXYPHENYL)-1H-1,2,4-TRIAZOLE
1Identification
【Name】
3,5-BIS(3,4-DIMETHOXYPHENYL)-1H-1,2,4-TRIAZOLE
【CAS】
【MDL】
MFCD01678683
【English Synonyms】
【Formula】
C18 H19 N3 O4
【MolWeight】
341.365
【Inchi】
InChI=1S/C18H19N3O4/c1-22-13-7-5-11(9-15(13)24-3)17-19-18(21-20-17)12-6-8-14(23-2)16(10-12)25-4/h5-10H,1-4H3,(H,19,20,21)
【InChIKey】
InChIKey=TZKVWSMMEAUSBV-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1OC)c2[nH]nc(n2)c3ccc(c(c3)OC)OC
【MOL File】
3,5-BIS(3,4-DIMETHOX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-BIS(3,4-DIMETHOXYPHENYL)-1H-1,2,4-TRIAZOLE.cml