593236-99-8
1H-INDOLE-3-CARBOXALDEHYDE,7-ETHYL-1-[(4-IODOPHENYL)METHYL]-
Name1H-INDOLE-3-CARBOXALDEHYDE,7-ETHYL-1-[(4-IODOPHENYL)METHYL]-
1Identification
【Name】
1H-INDOLE-3-CARBOXALDEHYDE,7-ETHYL-1-[(4-IODOPHENYL)METHYL]-
【CAS】
【MDL】
MFCD03906478
【English Synonyms】
【Formula】
C18 H16 I N O
【MolWeight】
389.23
【Inchi】
InChI=1S/C18H16INO/c1-2-14-4-3-5-17-15(12-21)11-20(18(14)17)10-13-6-8-16(19)9-7-13/h3-9,11-12H,2,10H2,1H3
【InChIKey】
InChIKey=KZOVTKINVSGRST-UHFFFAOYSA-N
【SMILES】
CCc1cccc2c1n(cc2C=O)Cc3ccc(cc3)I
【MOL File】
1H-INDOLE-3-CARBOXAL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-INDOLE-3-CARBOXALDEHYDE,7-ETHYL-1-[(4-IODOPHENYL)METHYL]-.cml