53013-59-5
2,5-BIS-[(E)-1H-INDOL-3-YLMETHYLIDENE]CYCLOPENTANONE
Name2,5-BIS-[(E)-1H-INDOL-3-YLMETHYLIDENE]CYCLOPENTANONE
1Identification
【Name】
2,5-BIS-[(E)-1H-INDOL-3-YLMETHYLIDENE]CYCLOPENTANONE
【CAS】
【MDL】
MFCD00365995
【English Synonyms】
【Formula】
C23 H18 N2 O
【MolWeight】
338.408
【Inchi】
InChI=1S/C23H18N2O/c26-23-15(11-17-13-24-21-7-3-1-5-19(17)21)9-10-16(23)12-18-14-25-22-8-4-2-6-20(18)22/h1-8,11-14,24-25H,9-10H2/b15-11+,16-12+
【InChIKey】
InChIKey=XWKQDPZDSGUBDK-JOBJLJCHSA-N
【SMILES】
c1ccc2c(c1)c(c[nH]2)/C=C/3\CC/C(=C\c4c[nH]c5c4cccc5)/C3=O
【MOL File】
2,5-BIS-[(E)-1H-INDO….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
2,5-BIS-[(E)-1H-INDOL-3-YLMETHYLIDENE]CYCLOPENTANONE.cml