1082470-14-1
METHYL 2,6-DIMETHYL-1H-INDOLE-3-CARBOXYLATE
NameMETHYL 2,6-DIMETHYL-1H-INDOLE-3-CARBOXYLATE
1Identification
【Name】
METHYL 2,6-DIMETHYL-1H-INDOLE-3-CARBOXYLATE
【CAS】
【MDL】
MFCD16875991
【English Synonyms】
【Formula】
C12 H13 N O2
【MolWeight】
203.24
【Inchi】
InChI=1S/C12H13NO2/c1-7-4-5-9-10(6-7)13-8(2)11(9)12(14)15-3/h4-6,13H,1-3H3
【InChIKey】
InChIKey=BHJAYIUKGMSMHA-UHFFFAOYSA-N
【SMILES】
Cc1ccc2c(c1)[nH]c(c2C(=O)OC)C
【MOL File】
METHYL 2,6-DIMETHYL-….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
METHYL 2,6-DIMETHYL-1H-INDOLE-3-CARBOXYLATE.cml