272438-12-7
1H-INDOLE-1,5-DICARBOXYLIC ACID, 2,3-DIHYDRO-, 1-(1,1-DIMETHYLETHYL) 5-METHYL ESTER
Name1H-INDOLE-1,5-DICARBOXYLIC ACID, 2,3-DIHYDRO-, 1-(1,1-DIMETHYLETHYL) 5-METHYL ESTER
1Identification
【Name】
1H-INDOLE-1,5-DICARBOXYLIC ACID, 2,3-DIHYDRO-, 1-(1,1-DIMETHYLETHYL) 5-METHYL ESTER
【CAS】
【MDL】
MFCD13183541
【English Synonyms】
【Formula】
C15 H19 N O4
【MolWeight】
277.318
【Inchi】
InChI=1S/C15H19NO4/c1-15(2,3)20-14(18)16-8-7-10-9-11(13(17)19-4)5-6-12(10)16/h5-6,9H,7-8H2,1-4H3
【InChIKey】
InChIKey=KANVSPBCQYQXFC-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCc2c1ccc(c2)C(=O)OC
【MOL File】
1H-INDOLE-1,5-DICARB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-INDOLE-1,5-DICARBOXYLIC ACID, 2,3-DIHYDRO-, 1-(1,1-DIMETHYLETHYL) 5-METHYL ESTER.cml