Tert-Butyl 3-Isocyanopropanoate

Molecule SVG Image

Properties Simple | Detailed

Formula C8H14NO2
IUPAC Name tert-butyl 3-isocyanopropanoate
Molecular Mass 156.202 g·mol−1
Heat of Formation -310.3 ± 16.7 kJ·mol−1
Dipole Moment 2.38 ± 1.08 D
Volume 215.41 Å 3
Surface Area 202.39 Å 2
HOMO Energy -10.62 ± 0.55 eV
LUMO Energy 4.10 ± eV
Point Group Symmetry C1
Synonyms
  • 3-isocyanopropanoic acid tert-butyl ester
  • 3-isocyanopropionic acid tert-butyl ester
  • beta-alanine tert-butyl ester isocyanide
  • tert-butyl 3-isocyanopropionate
InChIKey KGVVZBHXRXWANI-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N