3-(1,3-Benzodioxol-5-Yl)Propanoic Acid

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Properties Simple | Detailed

Formula C10H10O4
IUPAC Name 3-(1,3-benzodioxol-5-yl)propanoic acid
Molecular Mass 194.184 g·mol−1
Heat of Formation -593.1 ± 16.7 kJ·mol−1
Dipole Moment 1.82 ± 1.08 D
Volume 221.61 Å 3
Surface Area 217.26 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
Synonyms
  • .beta.(3,4-methylenedioxyphenyl)propionic acid
  • 1,3-benzodioxole-5-propanoic acid
  • 3,4-(methylenedioxy)hydrocinnamic acid
  • 3,4-methylenedioxydihydrocinnamic acid
  • 3,4-methylenedioxyhydrocinnamic acid
  • 3-(1,3-benzodioxol-5-yl)propionic acid
  • 3-(3,4-methylenedioxyphenyl)propionic acid
  • benzo-1,3-dioxole-5-propionic acid
  • hydrocinnamic acid, 3,4-(methylenedioxy)-
  • oprea1_823033
  • sdccgmls-0065841.p001
  • sr-01000635976-1
CAS Number(s)
  • 2815-95-4
InChIKey UIYJGLLTSVRSBM-UHFFFAOYSA-N
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