Arecaidine

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Properties Simple | Detailed

Formula C7H11NO2
IUPAC Name (1s)-1-methyl-3,6-dihydro-2h-pyridine-5-carboxylic acid
Molecular Mass 141.168 g·mol−1
Heat of Formation -323.1 ± 16.7 kJ·mol−1
Dipole Moment 2.90 ± 1.08 D
Volume 174.42 Å 3
Surface Area 175.28 Å 2
HOMO Energy -9.01 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2,5,6-tetrahydro-1-methyl-3-pyridinecarboxylic acid
  • 1-methyl-5,6-dihydro-2h-pyridine-3-carboxylic acid
  • 3-pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl-
  • 3-pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl- (9ci)
  • arecaine
  • methylguvacine
  • n-methylguvacine
  • nicotinic acid, 1,2,5,6-tetrahydro-1-methyl-
CAS Number(s)
  • 499-04-7
InChIKey DNJFTXKSFAMXQF-UHFFFAOYSA-N
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