4-Methyl-7-(2-Methylenebutanoyl)-2H-1,4-Benzoxazin-3(4H)-One

Molecule SVG Image

Properties Simple | Detailed

Formula C14H15NO3
IUPAC Name 4-methyl-7-(2-methylenebutanoyl)-1,4-benzoxazin-3-one
Molecular Mass 245.274 g·mol−1
Heat of Formation -342.2 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 293.27 Å 3
Surface Area 269.01 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1,4-benzoxazin-3(4h)-one, 4-methyl-7-(2-methylene-1-oxobutyl)-
  • 4-methyl-7-(2-methylene-1-oxobutyl)-1,4-benzoxazin-3-one
  • 4-methyl-7-(2-methylene-1-oxobutyl)-2h-1,4-benzoxazin-3(4h)-one
  • 4-methyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one
  • 7-(2-ethylacryloyl)-4-methyl-1,4-benzoxazin-3-one
CAS Number(s)
  • 116337-81-6
InChIKey KALQVNGZTBLJJY-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N