9-Hydroxybenzo[A]Pyrene

Molecule SVG Image

Properties Simple | Detailed

Formula C20H12O
IUPAC Name benzo[a]pyren-9-ol
Molecular Mass 268.309 g·mol−1
Heat of Formation 149.2 ± 16.7 kJ·mol−1
Dipole Moment 1.77 ± 1.08 D
Volume 306.47 Å 3
Surface Area 276.35 Å 2
HOMO Energy -8.06 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry Cs
Synonyms
  • 9-benzo[a]pyrenol
  • 9-hydroxybenzo(a)pyrene
  • benzo(a)pyren-9-ol
  • benzo(a)pyrene, 9-hydroxy-
CAS Number(s)
  • 17573-21-6
InChIKey OBBBXCAFTKLFGZ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O