88340-85-6
(2E,5Z)-2-[(DIMETHYLAMINO)METHYLENE]-5-[(2Z)-2-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)ETHYLIDENE]CYCLOPENTANONE
Name(2E,5Z)-2-[(DIMETHYLAMINO)METHYLENE]-5-[(2Z)-2-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)ETHYLIDENE]CYCLOPENTANONE
1Identification
【Name】
(2E,5Z)-2-[(DIMETHYLAMINO)METHYLENE]-5-[(2Z)-2-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)ETHYLIDENE]CYCLOPENTANONE
【CAS】
【MDL】
MFCD06409662
【English Synonyms】
【Formula】
C21 H26 N2 O
【MolWeight】
322.449
【Inchi】
InChI=1S/C21H26N2O/c1-21(2)17-8-6-7-9-18(17)23(5)19(21)13-12-15-10-11-16(20(15)24)14-22(3)4/h6-9,12-14H,10-11H2,1-5H3/b15-12-,16-14+,19-13-
【InChIKey】
InChIKey=BUUCESFHCDLULK-QLJDRZGOSA-N
【SMILES】
CC\1(c2ccccc2N(/C1=C\C=C/3\CC/C(=C\N(C)C)/C3=O)C)C
【MOL File】
(2E,5Z)-2-[(DIMETHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(2E,5Z)-2-[(DIMETHYLAMINO)METHYLENE]-5-[(2Z)-2-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)ETHYLIDENE]CYCLOPENTANONE.cml