51720-10-6
4-PHENYL-5-(5-PHENYL-1H-PYRAZOL-3-YL)-1H-1,2,3-TRIAZOLE
Name4-PHENYL-5-(5-PHENYL-1H-PYRAZOL-3-YL)-1H-1,2,3-TRIAZOLE
1Identification
【Name】
4-PHENYL-5-(5-PHENYL-1H-PYRAZOL-3-YL)-1H-1,2,3-TRIAZOLE
【CAS】
【MDL】
MFCD18969836
【English Synonyms】
【Formula】
C17 H13 N5
【MolWeight】
287.325
【Inchi】
InChI=1S/C17H13N5/c1-3-7-12(8-4-1)14-11-15(19-18-14)17-16(20-22-21-17)13-9-5-2-6-10-13/h1-11H,(H,18,19)(H,20,21,22)
【InChIKey】
InChIKey=RBAIZKVLTZPIEH-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)c2cc(n[nH]2)c3c(nn[nH]3)c4ccccc4
【MOL File】
4-PHENYL-5-(5-PHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-PHENYL-5-(5-PHENYL-1H-PYRAZOL-3-YL)-1H-1,2,3-TRIAZOLE.cml