Chemical Properties of 6H,12H-Dibenzo[b,f][1,5]dioxocine-6,12-dione

6H,12H-Dibenzo[b,f][1,5]dioxocine-6,12-dione

InChI
InChI=1S/C14H8O4/c15-13-9-5-1-3-7-11(9)17-14(16)10-6-2-4-8-12(10)18-13/h1-8H
InChI Key
MLSVGAXOQBMEGH-UHFFFAOYSA-N
Formula
C14H8O4
SMILES
O=C1Oc2ccccc2C(=O)Oc2ccccc21
Molecular Weight1
240.21
Other Names
  • Benzoic acid, 2-hydroxy-, bimol. cyclic ester
  • Disalicylide
  • Salicylic acid, bimol. cyclic ester
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfH°gas -426.68 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 31.42 kJ/mol Joback Calculated Property
IE 8.83 eV Relay (1.0) Calculated Property
log10WS -4.60 Relay (1.0) Calculated Property
logPoct/wat 2.438 Crippen Calculated Property
McVol 164.620 ml/mol McGowan Calculated Property
Pc 2979.54 kPa Joback Calculated Property
Inp [2034.00; 2034.00]   Show Hide
Inp 2034.00 NIST
Inp 2034.00 NIST
Tboil 646.64 K Relay (1.0) Calculated Property
Tc 949.16 K Relay (1.0) Calculated Property
Tfus 462.24 K Relay (1.0) Calculated Property
Vc 0.610 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [214.71; 482.43] 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-3.90500e+01
Coefficient B1.15360e+00
Coefficient C-8.91720e-04
Coefficient D2.59600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 214.71 J/mol×K 273.00 Calculated Property
Cp,gas 268.96 J/mol×K 353.78 Calculated Property
Cp,gas 315.17 J/mol×K 434.56 Calculated Property
Cp,gas 354.15 J/mol×K 515.33 Calculated Property
Cp,gas 386.74 J/mol×K 596.11 Calculated Property
Cp,gas 413.75 J/mol×K 676.89 Calculated Property
Cp,gas 436.01 J/mol×K 757.67 Calculated Property
Cp,gas 454.32 J/mol×K 838.44 Calculated Property
Cp,gas 469.52 J/mol×K 919.22 Calculated Property
Cp,gas 482.43 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0018108; 0.0006225] Pa×s [442.82; 654.02] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-9.62047e+00
Coefficient B1.46418e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.442.82
Temperature range, max.654.02
η 0.0018108 Pa×s 442.82 Calculated Property
η 0.0015332 Pa×s 466.29 Calculated Property
η 0.0013191 Pa×s 489.75 Calculated Property
η 0.0011505 Pa×s 513.22 Calculated Property
η 0.0010156 Pa×s 536.69 Calculated Property
η 0.0009059 Pa×s 560.15 Calculated Property
η 0.0008155 Pa×s 583.62 Calculated Property
η 0.0007402 Pa×s 607.09 Calculated Property
η 0.0006766 Pa×s 630.55 Calculated Property
η 0.0006225 Pa×s 654.02 Calculated Property

Similar Compounds

6H,12H,18H-Tribenzo[b,f,j][1,5,9]trioxacyclododecin, 6,12,18-tri(oxo)-. o-Methoxybenzoic acid, phenyl ester. O-(SALICYLOYLOXY)BENZOIC ACID. o-Anisic acid, 4-methoxyphenyl ester. 3,9-dimethoxy-6H,12H-dibenzo[b,f][1,5]dioxocine-6,12-dione. o-Anisic acid, 4-cyanophenyl ester. Benzoic acid, 2-hydroxy-, phenyl ester. o-Anisic acid, 2-naphthyl ester. o-Anisic acid, 4-chlorophenyl ester. o-Methoxybenzoic acid, 2-methylphenyl ester. o-Anisic acid, 3-methylphenyl ester. o-Methoxybenzoic acid, 3,5-difluorophenyl ester. 4-Chlorophenyl salicylate. 3-Methoxyphenyl salicylate. o-Anisic acid, 3,4-dichlorophenyl ester.

Find more compounds similar to 6H,12H-Dibenzo[b,f][1,5]dioxocine-6,12-dione.

Sources

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.