3-[(4-Chlorophenyl)Carbamoyl]-2-Naphthyl Dihydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C17H13ClNO5P
IUPAC Name [7-[(4-chlorophenyl)carbamoyl]tetralin-1,2,3,4-tetraid-6-yl] dihydrogen phosphate
Molecular Mass 377.716 g·mol−1
Heat of Formation -977.0 ± 16.7 kJ·mol−1
Dipole Moment 5.65 ± 1.08 D
Volume 396.66 Å 3
Surface Area 351.26 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
Synonyms
  • [3-[(4-chlorophenyl)carbamoyl]-2-naphthyl] dihydrogen phosphate
  • [3-[(4-chlorophenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate
  • [3-[[(4-chlorophenyl)amino]-oxomethyl]-2-naphthyl] dihydrogen phosphate
  • kg-501
  • n-(4-chlorophenyl)-3-(phosphonooxy)naphthalene-2-carboxamide
  • n3p
  • naphthol as-e phosphate
CAS Number(s)
  • 18228-17-6
InChIKey RQAQWBFHPMSXKR-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O N P