3-Methyl-1,2-Oxazole-5-Carboxylic Acid

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Properties Simple | Detailed

Formula C5H5NO3
IUPAC Name 3-methylisoxazole-5-carboxylic acid
Molecular Mass 127.098 g·mol−1
Heat of Formation -287.5 ± 16.7 kJ·mol−1
Dipole Moment 3.85 ± 1.08 D
Volume 139.93 Å 3
Surface Area 151.03 Å 2
HOMO Energy -10.94 ± 0.55 eV
LUMO Energy 1.91 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-methyl-5-isoxazolecarboxylic acid
  • 3-methyl-isoxazole-5-carboxylic acid
  • ae-848/32806047
  • bas 10142371
  • zero/005930
InChIKey HXIYCKAAQPHZBM-UHFFFAOYSA-N
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