763126-18-7
2-((4-(1H-1,2,4-TRIAZOL-1-YL)ANILINO)METHYL)BENZENOL
Name2-((4-(1H-1,2,4-TRIAZOL-1-YL)ANILINO)METHYL)BENZENOL
1Identification
【Name】
2-((4-(1H-1,2,4-TRIAZOL-1-YL)ANILINO)METHYL)BENZENOL
【CAS】
【MDL】
MFCD05155037
【English Synonyms】
【Formula】
C15 H14 N4 O
【MolWeight】
266.303
【Inchi】
InChI=1S/C15H14N4O/c20-15-4-2-1-3-12(15)9-17-13-5-7-14(8-6-13)19-11-16-10-18-19/h1-8,10-11,17,20H,9H2
【InChIKey】
InChIKey=NDQIUIGWJOIATQ-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)CNc2ccc(cc2)n3cncn3)O
【MOL File】
2-((4-(1H-1,2,4-TRIA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-((4-(1H-1,2,4-TRIAZOL-1-YL)ANILINO)METHYL)BENZENOL.cml