88611-94-3
ETHYL 5-METHYL-1H-INDOLE-3-CARBOXYLATE
NameETHYL 5-METHYL-1H-INDOLE-3-CARBOXYLATE
1Identification
【Name】
ETHYL 5-METHYL-1H-INDOLE-3-CARBOXYLATE
【CAS】
【MDL】
MFCD06204662
【English Synonyms】
【Formula】
C12 H13 N O2
【MolWeight】
203.24
【Inchi】
InChI=1S/C12H13NO2/c1-3-15-12(14)10-7-13-11-5-4-8(2)6-9(10)11/h4-7,13H,3H2,1-2H3
【InChIKey】
InChIKey=YHDOEUDINHQBDO-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c[nH]c2c1cc(cc2)C
【MOL File】
ETHYL 5-METHYL-1H-IN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 5-METHYL-1H-INDOLE-3-CARBOXYLATE.cml