Chemical Properties of 1H-Phenalen-1-one (CAS 548-39-0)

1H-Phenalen-1-one

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C13H8O/c14-12-8-7-10-4-1-3-9-5-2-6-11(12)13(9)10/h1-8H
InChI Key
WWBGWPHHLRSTFI-UHFFFAOYSA-N
Formula
C13H8O
SMILES
O=C1C=Cc2cccc3cccc1c32
Molecular Weight1
180.20
CAS
548-39-0
Other Names
  • 7-Perinaphthenone
  • Perinaphthanone
  • Perinaphthenone
  • Phenalen-1-one
  • Phenalenone
Sources

Physical Properties

Property Value Unit Source
Δf 234.21 kJ/mol Joback Calculated Property
Δfgas 106.23 kJ/mol Joback Calculated Property
Δfus 17.50 kJ/mol Joback Calculated Property
Δvap 54.53 kJ/mol Joback Calculated Property
IE 8.20 ± 0.04 eV NIST
logPoct/wat 3.05 Crippen Calculated Property
Pc 3517.91 kPa Joback Calculated Property
Tboil 630.85 K Joback Calculated Property
Tc 892.23 K Joback Calculated Property
Tfus 411.59 K Joback Calculated Property
Vc 0.53 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 329.11 J/mol×K 630.85 Joback Calculated Property
ΔsubH 97.20 ± 2.50 kJ/mol 337.0 NIST

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 4
>C=O (ring) 1
=CH- (ring) 8

Similar Compounds

1H-phenalene. 1H-Benz[de]anthracene. 4H-Dibenz[a,kl]anthracene. 3H-Benzo[cd]pyrene. 1H-Dibenz[a,kl]anthracene. 1H-Phenalen-1-one,9-ethoxy-. 5H-Benz[fg]acenaphthylene. 3-(4-Methoxyphenyl)-1-(2-naphthyl)prop-2-en-1-one. 1H-Cyclopenta[e]pyrene. 1H-Cyclopenta[l]phenanthrene. 1H-Benzo[cd]fluoranthene. 1H-Benz[e]indene. 3H-Benz[e]indene. 1-Acenaphenone. 1H-Cyclopent[a]anthracene.

Find more compounds similar to 1H-Phenalen-1-one.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.