Chemical Properties of 2-Benzoyl-1,3-indanedione (CAS 1785-95-1)

2-Benzoyl-1,3-indanedione

InChI
InChI=1S/C16H10O3/c17-14(10-6-2-1-3-7-10)13-15(18)11-8-4-5-9-12(11)16(13)19/h1-9,13H
InChI Key
UURMMRCWXJLUKF-UHFFFAOYSA-N
Formula
C16H10O3
SMILES
O=C(c1ccccc1)C1C(=O)c2ccccc2C1=O
Molecular Weight1
250.25
CAS
1785-95-1
Other Names
  • 1,3-Indandione, 2-benzoyl-
  • Benzoylindandione
  • 2-Benzoyl-1,3-indandione
  • 1H-Indene-1,3(2H)-dione, 2-benzoyl-
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Physical Properties

Property Value Unit Source
ω 0.5757 Relay (1.0) Calculated Property
ΔfG° -14.32 kJ/mol Joback Calculated Property
ΔfH°gas -210.85 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 23.64 kJ/mol Joback Calculated Property
ΔvapH° 93.46 kJ/mol Relay (1.0) Calculated Property
IE 8.72 eV Relay (1.0) Calculated Property
log10WS -3.51 Relay (1.0) Calculated Property
logPoct/wat 2.565 Crippen Calculated Property
McVol 182.630 ml/mol McGowan Calculated Property
Pc 2940.89 kPa Joback Calculated Property
Tboil 642.79 K Relay (1.0) Calculated Property
Tc 967.32 K Relay (1.0) Calculated Property
Tfus 420.83 K Relay (1.0) Calculated Property
Vc 0.654 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [223.16; 571.71] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.51900e+01
Coefficient B1.09280e+00
Coefficient C-5.55460e-04
Coefficient D6.95600e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 223.16 J/mol×K 273.00 Calculated Property
Cp,gas 284.98 J/mol×K 353.78 Calculated Property
Cp,gas 340.51 J/mol×K 434.56 Calculated Property
Cp,gas 389.97 J/mol×K 515.33 Calculated Property
Cp,gas 433.59 J/mol×K 596.11 Calculated Property
Cp,gas 471.59 J/mol×K 676.89 Calculated Property
Cp,gas 504.18 J/mol×K 757.67 Calculated Property
Cp,gas 531.58 J/mol×K 838.44 Calculated Property
Cp,gas 554.02 J/mol×K 919.22 Calculated Property
Cp,gas 571.71 J/mol×K 1000.00 Calculated Property

Similar Compounds

1H-Indene-1,3(2H)-dione. Pindone. Propane-1,3-dione, 1,3-diphenyl-2-(4-methoxybenzoyl)-. Dibenzoylacetic acid, ethyl ester. Dibenzoylmethane. 1H-Indene-1,3(2H)-dione, 2-(diphenylacetyl)-. 1,3-Propanedione, 2-bromo-1,3-diphenyl-. 1H-Indene-1,3(2H)-dione, 2-[(4-chlorophenyl)phenylacetyl]-. 2-Phenylindane-1,3-dione. Benzoic acid, 2-(1-oxopropyl)-. 2'-Methylbutyrophenone. 4-methylindanone. 2,2-Dihydroxyindan-1,3-dione. 1H-Inden-1-one, 2,3-dihydro-. 2-(Trifluoromethyl)propiophenone.

Find more compounds similar to 2-Benzoyl-1,3-indanedione.

Sources

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