Benzo(A)Pyrenol

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Properties Simple | Detailed

Formula C20H12O
IUPAC Name benzo[a]pyren-1-ol
Molecular Mass 268.309 g·mol−1
Heat of Formation 149.6 ± 16.7 kJ·mol−1
Dipole Moment 1.56 ± 1.08 D
Volume 305.95 Å 3
Surface Area 274.48 Å 2
HOMO Energy -7.97 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-benzo[i]pyrenol
  • 1-hydroxybenzo(a)pyrene
  • benzo(a)pyren-1-ol
  • benzo[i]pyren-1-ol
CAS Number(s)
  • 13345-23-8
InChIKey GPIRWWPRDKGKPS-UHFFFAOYSA-N
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DOI
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Elements H C O