283607-84-1
ETHYL 2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE
NameETHYL 2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE
1Identification
【Name】
ETHYL 2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE
【CAS】
【MDL】
MFCD12912107
【English Synonyms】
【Formula】
C13 H15 N O3
【MolWeight】
233.266
【Inchi】
InChI=1S/C13H15NO3/c1-3-10-12(13(16)17-4-2)9-7-8(15)5-6-11(9)14-10/h5-7,14-15H,3-4H2,1-2H3
【InChIKey】
InChIKey=PXZGKXQADLHGKD-UHFFFAOYSA-N
【SMILES】
CCc1c(c2cc(ccc2[nH]1)O)C(=O)OCC
【MOL File】
ETHYL 2-ETHYL-5-HYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE.cml