208511-13-1
1H-INDOLE-1-CARBOXYLIC ACID, 4-AMINO-2,3-DIHYDRO-7-METHYL-, 1,1-DIMETHYLETHYL ESTER
Name1H-INDOLE-1-CARBOXYLIC ACID, 4-AMINO-2,3-DIHYDRO-7-METHYL-, 1,1-DIMETHYLETHYL ESTER
1Identification
【Name】
1H-INDOLE-1-CARBOXYLIC ACID, 4-AMINO-2,3-DIHYDRO-7-METHYL-, 1,1-DIMETHYLETHYL ESTER
【CAS】
【MDL】
MFCD13183553
【English Synonyms】
【Formula】
C14 H20 N2 O2
【MolWeight】
248.324
【Inchi】
InChI=1S/C14H20N2O2/c1-9-5-6-11(15)10-7-8-16(12(9)10)13(17)18-14(2,3)4/h5-6H,7-8,15H2,1-4H3
【InChIKey】
InChIKey=TVZGQZOAPIZUBZ-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c2c1N(CC2)C(=O)OC(C)(C)C)N
【MOL File】
1H-INDOLE-1-CARBOXYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-INDOLE-1-CARBOXYLIC ACID, 4-AMINO-2,3-DIHYDRO-7-METHYL-, 1,1-DIMETHYLETHYL ESTER.cml