Chemical Properties of Anthrone (CAS 90-44-8)

Anthrone

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InChI
InChI=1S/C14H10O/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-8H,9H2
InChI Key
RJGDLRCDCYRQOQ-UHFFFAOYSA-N
Formula
C14H10O
SMILES
O=C1c2ccccc2Cc2ccccc21
Molecular Weight1
194.23
CAS
90-44-8
Other Names
  • (10H)-9-Anthracenone
  • 9(10H)-Anthracenone
  • 9,10-Dihydro-9-oxoanthracene
  • Anthracene, 9,10-dihydro-9-oxo-
  • Carbothrone
Sources

Physical Properties

Property Value Unit Source
Δcsolid -6858.40 ± 1.90 kJ/mol NIST
Δf 230.53 kJ/mol Joback Calculated Property
Δfgas 23.40 ± 2.20 kJ/mol NIST
Δfsolid -79.90 ± 2.10 kJ/mol NIST
Δfus 17.99 kJ/mol Joback Calculated Property
Δsub [103.30; 106.10] kJ/mol Show Hide
Δsub 106.10 ± 0.80 kJ/mol NIST
Δsub 103.30 kJ/mol NIST
Δsub 103.32 ± 0.63 kJ/mol NIST
Δsub 103.30 kJ/mol NIST
Δvap 56.93 kJ/mol Joback Calculated Property
IE [8.80; 9.43] eV Show Hide
IE 8.82 ± 0.02 eV NIST
IE 8.80 eV NIST
IE 8.83 ± 0.03 eV NIST
IE 8.83 ± 0.03 eV NIST
IE 9.43 eV NIST
logPoct/wat 2.82 Crippen Calculated Property
Pc 3239.34 kPa Joback Calculated Property
Tboil 658.00 K Joback Calculated Property
Tc 922.12 K Joback Calculated Property
Tfus 428.15 ± 3.00 K NIST
Vc 0.58 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 379.22 J/mol×K 658.0 Joback Calculated Property
ΔfusH 26.80 kJ/mol 429.0 NIST
ΔfusH 26.80 kJ/mol 429.0 NIST
ΔfusH 26.80 kJ/mol 429.0 NIST
ΔsubH 1037.30 kJ/mol 298.15 NIST
ΔsubH 99.60 kJ/mol 354.0 NIST

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 4
>C=O (ring) 1
-CH2- (ring) 1
=CH- (ring) 8

Similar Compounds

9,10-Anthraquinone. O-dibenzoylbenzene. Methanone, (2-methylphenyl)phenyl-. 6,13-Pentacenedione. 5,12-Naphthacenedione. 9,10-Anthracenedione, 2-methyl-. 9,10-Anthracenedione, 1-methyl-. 2,4-DIMETHYLBENZOPHENONE. 2,5-Dimethylbenzophenone. Benzophenone, 2,4,6-trimethyl-. 9,10-Anthracenedione, 2-ethyl-. 2-Chloroanthraquinone. 9,10-Anthracenedione, 2-hydroxy-. Anthraflavic acid. 2-Aminoanthraquinone.

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