Chemical Properties of 2(2-Acetyl-1-phenylethyl) 1,3-indandione (CAS 1785-98-4)

2(2-Acetyl-1-phenylethyl) 1,3-indandione

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InChI
InChI=1S/C19H16O3/c1-12(20)11-16(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-15(14)19(17)22/h2-10,16-17H,11H2,1H3
InChI Key
KJULKZCUOFDKHU-UHFFFAOYSA-N
Formula
C19H16O3
SMILES
CC(=O)CC(c1ccccc1)C1C(=O)c2ccccc2C1=O
Molecular Weight1
292.33
CAS
1785-98-4
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Physical Properties

Property Value Unit Source
ΔfG° 8.50 kJ/mol Joback Calculated Property
ΔfH°gas -294.36 kJ/mol Joback Calculated Property
ΔfusH° 27.89 kJ/mol Joback Calculated Property
ΔvapH° 77.87 kJ/mol Joback Calculated Property
log10WS -4.56 Crippen Calculated Property
logPoct/wat 3.445 Crippen Calculated Property
McVol 224.900 ml/mol McGowan Calculated Property
Pc 2216.62 kPa Joback Calculated Property
Tboil 888.27 K Joback Calculated Property
Tc 1149.18 K Joback Calculated Property
Tfus 558.56 K Joback Calculated Property
Vc 0.855 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [693.38; 756.23] J/mol×K [888.27; 1149.18] Show Hide
Cp,gas 693.38 J/mol×K 888.27 Joback Calculated Property
Cp,gas 707.74 J/mol×K 931.76 Joback Calculated Property
Cp,gas 720.47 J/mol×K 975.24 Joback Calculated Property
Cp,gas 731.64 J/mol×K 1018.73 Joback Calculated Property
Cp,gas 741.29 J/mol×K 1062.21 Joback Calculated Property
Cp,gas 749.47 J/mol×K 1105.70 Joback Calculated Property
Cp,gas 756.23 J/mol×K 1149.18 Joback Calculated Property

Similar Compounds

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Sources

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