2-(3-Amino-2,5,6-Trimethoxyphenyl)Ethyl 5-Chloro-2,4-Dihydroxybenzoate

Molecule SVG Image

Properties Simple | Detailed

Formula C18H20ClNO7
IUPAC Name 2-(3-amino-2,5,6-trimethoxy-phenyl)ethyl 5-chloro-2,4-dihydroxy-benzoate
Molecular Mass 397.807 g·mol−1
Heat of Formation -1086.1 ± 16.7 kJ·mol−1
Dipole Moment 5.72 ± 1.08 D
Volume 435.3 Å 3
Surface Area 392.59 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
Synonyms
  • 5-chloro-2,4-dihydroxy-benzoic acid 2-(3-amino-2,5,6-trimethoxy-phenyl)ethyl ester
  • 5-chloro-2,4-dihydroxybenzoic acid 2-(3-amino-2,5,6-trimethoxyphenyl)ethyl ester
InChIKey DFYGLJKFZQGYPA-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C Cl O N