51842-50-3
ETHYL 4-(1H-INDOL-3-YL)-2,4-DIOXOBUTANOATE
NameETHYL 4-(1H-INDOL-3-YL)-2,4-DIOXOBUTANOATE
1Identification
【Name】
ETHYL 4-(1H-INDOL-3-YL)-2,4-DIOXOBUTANOATE
【CAS】
【MDL】
MFCD01101510
【English Synonyms】
【Formula】
C14 H13 N O4
【MolWeight】
259.26
【Inchi】
InChI=1S/C14H13NO4/c1-2-19-14(18)13(17)7-12(16)10-8-15-11-6-4-3-5-9(10)11/h3-6,8,15H,2,7H2,1H3
【InChIKey】
InChIKey=KHBIPUCDJHOGEE-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(=O)CC(=O)c1c[nH]c2c1cccc2
【MOL File】
ETHYL 4-(1H-INDOL-3-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 4-(1H-INDOL-3-YL)-2,4-DIOXOBUTANOATE.cml