(2S)-[6-Bromo-4-(4-Chlorophenyl)-2-Methyl-3-Quinolinyl](Methoxy)Acetic Acid

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Properties Simple | Detailed

Formula C19H15BrClNO3
IUPAC Name (2s)-2-[6-bromo-4-(4-chlorophenyl)-2-methyl-3-quinolyl]-2-methoxy-acetic acid
Molecular Mass 420.684 g·mol−1
Heat of Formation -300.7 ± 16.7 kJ·mol−1
Dipole Moment 2.03 ± 1.08 D
Volume 417.64 Å 3
Surface Area 354.21 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -1.19 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[6-bromo-4-(4-chlorophenyl)-2-methyl-3-quinolyl]-2-methoxy-acetic acid
  • (2s)-2-[6-bromo-4-(4-chlorophenyl)-2-methyl-3-quinolyl]-2-methoxyacetic acid
  • (2s)-2-[6-bromo-4-(4-chlorophenyl)-2-methyl-quinolin-3-yl]-2-methoxy-ethanoic acid
  • (2s)-2-[6-bromo-4-(4-chlorophenyl)-2-methylquinolin-3-yl]-2-methoxyacetic acid
InChIKey BNDPDYQQAJUJPY-SFHVURJKSA-N
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Elements C Cl H O N Br