2,2-Dimethyl-3-Oxo-2,3-Dihydro-1-Benzofur-7-Yl-Methylcarbamat

Molecule SVG Image

Properties Simple | Detailed

Formula C12H13NO4
IUPAC Name (2,2-dimethyl-3-oxo-benzofuran-7-yl) n-methylcarbamate
Molecular Mass 235.236 g·mol−1
Heat of Formation -572.3 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 274.53 Å 3
Surface Area 256.11 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • (2,2-dimethyl-3-oxo-1-benzofuran-7-yl) n-methylcarbamate
  • (2,2-dimethyl-3-oxo-benzofuran-7-yl) n-methylcarbamate
  • 3(2h)-benzofuranone, 2,2-dimethyl-7-(((methylamino)carbonyl)oxy)- (9ci)
  • 3-ketocarbofuran
  • 3-oxocarbofuran
  • carbamic acid, methyl-, ester with 2,2-dimethyl-7-hydroxy-3(2h)-benzofuranone
  • carbofuran 3-keto
  • carbofuran-3-keto
  • n-methylcarbamic acid (2,2-dimethyl-3-oxo-7-benzofuranyl) ester
  • n-methylcarbamic acid (3-keto-2,2-dimethyl-benzofuran-7-yl) ester
CAS Number(s)
  • 16709-30-1
InChIKey WXNZYYXXILQTKX-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N