170143-39-2
2,3-QUINOLINEDICARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, 3-METHYL ESTER
Name2,3-QUINOLINEDICARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, 3-METHYL ESTER
1Identification
【Name】
2,3-QUINOLINEDICARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, 3-METHYL ESTER
【CAS】
【MDL】
MFCD13192057
【English Synonyms】
【Formula】
C12 H8 Cl N O5
【MolWeight】
281.65
【Inchi】
InChI=1S/C12H8ClNO5/c1-19-12(18)8-9(11(16)17)14-7-4-5(13)2-3-6(7)10(8)15/h2-4H,1H3,(H,14,15)(H,16,17)
【InChIKey】
InChIKey=JERBLEWVWBLVCO-UHFFFAOYSA-N
【SMILES】
COC(=O)c1c(=O)c2ccc(cc2[nH]c1C(=O)O)Cl
【MOL File】
2,3-QUINOLINEDICARBO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,3-QUINOLINEDICARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, 3-METHYL ESTER.cml