37123-09-4
2,4,6,8-TETRAPHENYL-9-BISPIDONE
Name2,4,6,8-TETRAPHENYL-9-BISPIDONE
1Identification
【Name】
2,4,6,8-TETRAPHENYL-9-BISPIDONE
【CAS】
【MDL】
MFCD00135956
【English Synonyms】
【Formula】
C31 H28 N2 O
【MolWeight】
444.575
【Inchi】
InChI=1S/C31H28N2O/c34-31-25-27(21-13-5-1-6-14-21)32-29(23-17-9-3-10-18-23)26(31)30(24-19-11-4-12-20-24)33-28(25)22-15-7-2-8-16-22/h1-20,25-30,32-33H/t25-,26+,27?,28?,29?,30?
【InChIKey】
InChIKey=ITTQAMYBEGYMAS-VVAHGRBPSA-N
【SMILES】
c1ccc(cc1)C2[C@H]3C(NC([C@H](C3=O)C(N2)c4ccccc4)c5ccccc5)c6ccccc6
【MOL File】
2,4,6,8-TETRAPHENYL-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,4,6,8-TETRAPHENYL-9-BISPIDONE.cml