β-Nitropropionic Acid

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Properties Simple | Detailed

Formula C3H5NO4
IUPAC Name 3-nitropropanoic acid
Molecular Mass 119.076 g·mol−1
Heat of Formation -453.8 ± 16.7 kJ·mol−1
Dipole Moment 3.13 ± 1.08 D
Volume 129.58 Å 3
Surface Area 141.14 Å 2
HOMO Energy -11.33 ± 0.55 eV
LUMO Energy 2.60 ± eV
Point Group Symmetry C1
Synonyms
  • .beta.-nitropropionic acid
  • 3-nitropropanoate
  • 3-nitropropionic acid
  • 3-npa
  • 3np
  • 504-88-1 (free acid)
  • beta-nitropropanoate
  • beta-nitropropanoic acid
  • bnp
  • bovinocidin
  • hiptagenic acid
  • nitropropionic acid, beta
  • propanoic acid, 3-nitro-
  • propanoic acid, 3-nitro- (9ci)
  • propionic acid, 3-nitro-
  • sdccgmls-0066769.p001
CAS Number(s)
  • 504-88-1
InChIKey WBLZUCOIBUDNBV-UHFFFAOYSA-N
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