2-Chloro-5-[(2,4,4-Trimethyl-1-Cyclohexen-1-Yl)Methyl]-1(5H)-Phenazinone

Molecule SVG Image

Properties Simple | Detailed

Formula C22H23ClN2O
IUPAC Name 2-chloro-5-[(2,4,4-trimethylcyclohexen-1-yl)methyl]-3,4,6,7,8,9-hexahydrophenazine-2,3,4,4a,5a,6,7,8,9,9a,10,10a-dodecaid-1-one
Molecular Mass 366.884 g·mol−1
Heat of Formation 68.1 ± 16.7 kJ·mol−1
Dipole Moment 10.09 ± 1.08 D
Volume 437.76 Å 3
Surface Area 357.5 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy 1.40 ± eV
Point Group Symmetry C1
Synonyms
  • 2-chloro-5-[(2,4,4-trimethyl-1-cyclohexenyl)methyl]-1-phenazinone
  • 2-chloro-5-[(2,4,4-trimethyl-1-cyclohexenyl)methyl]phenazin-1-one
  • ws 9659 b
  • ws-9659b
CAS Number(s)
  • 123313-61-1
InChIKey UTTPOQJPJBHXNA-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O Cl