Chemical Properties of Anisindione (CAS 117-37-3)

Anisindione

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InChI
InChI=1S/C16H12O3/c1-19-11-8-6-10(7-9-11)14-15(17)12-4-2-3-5-13(12)16(14)18/h2-9,14H,1H3
InChI Key
XRCFXMGQEVUZFC-UHFFFAOYSA-N
Formula
C16H12O3
SMILES
COc1ccc(C2C(=O)c3ccccc3C2=O)cc1
Molecular Weight1
252.26
CAS
117-37-3
Other Names
  • 1H-Indene-1,3(2H)-dione, 2-(4-methoxyphenyl)-
  • 1,3-Indandione, 2-(p-methoxyphenyl)-
  • Anisin indandione
  • 2-p-Anisyl-1,3-indandione
  • 2-(p-Methoxyphenyl)-1,3-indandione
  • 2-(4-Methoxyphenyl)-1H-indene-1,3(2H)-dione
  • 2-(p-Methoxyphenyl)indane-1,3-dione
  • Miradon
  • SPE 2792
  • Unidone
  • Andion
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Physical Properties

Property Value Unit Source
ΔfG° -0.03 kJ/mol Joback Calculated Property
ΔfH°gas -258.27 kJ/mol Joback Calculated Property
ΔfusH° 22.84 kJ/mol Joback Calculated Property
ΔvapH° 67.90 kJ/mol Joback Calculated Property
log10WS -3.97 Crippen Calculated Property
logPoct/wat 2.858 Crippen Calculated Property
McVol 186.930 ml/mol McGowan Calculated Property
Pc 2659.77 kPa Joback Calculated Property
Inp 2273.00 NIST
Tboil 793.60 K Joback Calculated Property
Tc 1059.11 K Joback Calculated Property
Tfus 524.57 K Joback Calculated Property
Vc 0.705 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [539.33; 608.73] J/mol×K [793.60; 1059.11] Show Hide
Cp,gas 539.33 J/mol×K 793.60 Joback Calculated Property
Cp,gas 554.80 J/mol×K 837.85 Joback Calculated Property
Cp,gas 568.72 J/mol×K 882.10 Joback Calculated Property
Cp,gas 581.06 J/mol×K 926.35 Joback Calculated Property
Cp,gas 591.85 J/mol×K 970.60 Joback Calculated Property
Cp,gas 601.07 J/mol×K 1014.86 Joback Calculated Property
Cp,gas 608.73 J/mol×K 1059.11 Joback Calculated Property

Similar Compounds

Phenindione. 1H-Indene-1,3(2H)-dione, 2-(2-pyridinyl)-. Dihydrodaidzein (keto). 1H-indene-1,3(2H)-dione, 2-(3-hydroxy-2-quinolinyl)-. Dihydrodaidzein (keto) di-7,4'-d9-TMS. Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, [5R-(5«alpha»,5a«beta»,8a«alpha»)]-. 5«alpha»-Androstan-17«alpha»-methyl-4«beta»,17«beta»-diol-3,2c-pyrazol, TMS. 4'-Hydroxystanozolol (5A-Androstan-17A-methyl-4',17B-diol-3,2c-pyrazol), TMS. 7-angelyl echinatine, diTMS, dihydro. propyl-cannabinolic acid, n-butyl-boronate. 7-tiglyl echinatine, diTMS, dihydro. 16A-Hydroxyoestrone, TMS. (3R)-trans-Dihydro-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]-2(3H)-furanone diTMS. Benzenepropanol, 3-hydroxy-4-(2-hydroxy-1-hydroxymethyl-2-(4-hydroxy-3-methoxyphenyl))ethyl, pentakis-TMS. Mirtazapine-M (nor-HO-) 2AC.

Find more compounds similar to Anisindione.

Sources

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