1-[(Methylsulfonyl)Oxy]-1H-Benzotriazole

Molecule SVG Image

Properties Simple | Detailed

Formula C7H7N3O3S
IUPAC Name benzotriazol-1-ium-2-id-1-yl methanesulfonate
Molecular Mass 213.214 g·mol−1
Heat of Formation -13.3 ± 16.7 kJ·mol−1
Dipole Moment 1.79 ± 1.08 D
Volume 218.61 Å 3
Surface Area 210.62 Å 2
HOMO Energy -9.93 ± 0.55 eV
LUMO Energy 1.53 ± eV
Point Group Symmetry C1
Synonyms
  • benzotriazol-1-yl methanesulfonate
  • methanesulfonic acid 1-benzotriazolyl ester
  • methanesulfonic acid benzotriazol-1-yl ester
InChIKey RVFMZBYPSSUAAR-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N