Methyl Hygrate Betaine

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Properties Simple | Detailed

Formula C7H14NO2+
IUPAC Name (2s)-1,1-dimethylpyrrolidin-1-ium-2-carboxylate
Molecular Mass 144.192 g·mol−1
Heat of Formation -295.2 ± 16.7 kJ·mol−1
Dipole Moment 11.50 ± 1.08 D
Volume 183.95 Å 3
Surface Area 171.66 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.01 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-1,1-dimethyl-2-pyrrolidin-1-iumcarboxylate
  • (2s)-1,1-dimethylpyrrolidin-1-ium-2-carboxylate
  • (2s)-1,1-dimethylpyrrolidinium-2-carboxylate
  • (s)-2-carboxylato-1,1-dimethylpyrrolidinium
  • n,n-dimethyl-l-proline
  • prestwick-08g03
  • pyrrolidinium, 2-carboxy-1,1-dimethyl-, inner salt, (2s)-
CAS Number(s)
  • 471-87-4
InChIKey CMUNUTVVOOHQPW-LURJTMIESA-N
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