(2Z)-2-[(3-Methylbutanoyl)Amino]-2-Butenoic Acid

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Properties Simple | Detailed

Formula C9H15NO3
IUPAC Name (z)-2-(3-methylbutanoylamino)but-2-enoic acid
Molecular Mass 185.220 g·mol−1
Heat of Formation -610.7 ± 16.7 kJ·mol−1
Dipole Moment 5.33 ± 1.08 D
Volume 238.62 Å 3
Surface Area 221.11 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 3.16 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-2-(3-methylbutanoylamino)but-2-enoic acid
  • (z)-2-(isovalerylamino)but-2-enoic acid
  • (z)-2-[(3-methyl-1-oxobutyl)amino]but-2-enoic acid
  • 2-butenoic acid, 2-((3-methyl-1-oxobutyl)amino)-, (z)-
  • 2-isovaleramidobut-2-enoic acid
  • 2-ivba
CAS Number(s)
  • 74589-24-5
InChIKey ZIQJERGSQODYKF-DAXSKMNVSA-N
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