586353-04-0
2-TRITYL-6,7-DIHYDRO-2H-INDAZOL-4(5H)-ONE
Name2-TRITYL-6,7-DIHYDRO-2H-INDAZOL-4(5H)-ONE
1Identification
【Name】
2-TRITYL-6,7-DIHYDRO-2H-INDAZOL-4(5H)-ONE
【CAS】
【MDL】
MFCD23099201
【English Synonyms】
【Formula】
C26 H22 N2 O
【MolWeight】
378.473
【Inchi】
InChI=1S/C26H22N2O/c29-25-18-10-17-24-23(25)19-28(27-24)26(20-11-4-1-5-12-20,21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-9,11-16,19H,10,17-18H2
【InChIKey】
InChIKey=WEXZMAIBYUWWLD-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)C(c2ccccc2)(c3ccccc3)n4cc5c(n4)CCCC5=O
【MOL File】
2-TRITYL-6,7-DIHYDRO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-TRITYL-6,7-DIHYDRO-2H-INDAZOL-4(5H)-ONE.cml