828938-82-5
1,2-DIHYDRO-2,2-DIMETHYL-6-QUINOLINECARBOXYLIC ACID METHYL ESTER
Name1,2-DIHYDRO-2,2-DIMETHYL-6-QUINOLINECARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
1,2-DIHYDRO-2,2-DIMETHYL-6-QUINOLINECARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD17017793
【English Synonyms】
【Formula】
C13 H15 N O2
【MolWeight】
217.266
【Inchi】
InChI=1S/C13H15NO2/c1-13(2)7-6-9-8-10(12(15)16-3)4-5-11(9)14-13/h4-8,14H,1-3H3
【InChIKey】
InChIKey=MFIPKIIJGXMQLZ-UHFFFAOYSA-N
【SMILES】
CC1(C=Cc2cc(ccc2N1)C(=O)OC)C
【MOL File】
1,2-DIHYDRO-2,2-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2-DIHYDRO-2,2-DIMETHYL-6-QUINOLINECARBOXYLIC ACID METHYL ESTER.cml