(4As,4Br,10Bs,12As)-2-Chloro-8-Methoxy-12A-Methyl-3,4,4A,4B,5,6,10B,11,12,12A-Decahydronaphtho[2,1-F]Isoquinolin-1(2H)-One

Molecule SVG Image

Properties Simple | Detailed

Formula C19H24ClNO2
IUPAC Name (4as,4br,10bs,12as)-2-chloro-8-methoxy-12a-methyl-4,4a,4b,5,6,10b,11,12-octahydro-3h-naphtho[2,1-f]isoquinolin-1-one
Molecular Mass 333.852 g·mol−1
Heat of Formation -286.4 ± 16.7 kJ·mol−1
Dipole Moment 4.51 ± 1.08 D
Volume 391.6 Å 3
Surface Area 329.79 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 2.66 ± eV
Point Group Symmetry C1
Synonyms
  • (4as,4br,10bs,12as)-2-chloro-8-methoxy-12a-methyl-4,4a,4b,5,6,10b,11,12-octahydro-3h-naphtho[2,1-f]isoquinolin-1-one
  • cmaheo
  • n-chloro-3-methoxy-17-aza-homo-1,3,5(10)-estratrien-17-one
CAS Number(s)
  • 114462-29-2
InChIKey IFCLUGMVWHEXEM-VXNCWWDNSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O Cl