- InChI
- InChI=1S/C11H6O10/c12-7(13)2-1-3(8(14)15)5(10(18)19)6(11(20)21)4(2)9(16)17/h1H,(H,12,13)(H,14,15)(H,16,17)(H,18,19)(H,20,21)
- InChI Key
- QNSOHXTZPUMONC-UHFFFAOYSA-N
- Formula
- C11H6O10
- SMILES
-
O=C(O)c1cc(C(=O)O)c(C(=O)O)c(C
(=O)O)c1C(=O)O - Molecular Weight1
- 298.16
- CAS
- 1585-40-6
- Other Names
-
- Pentacarboxy benzene
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 1.4014 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -3256.40 ± 1.20 | kJ/mol | NIST |
| ΔfG° | -1213.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1661.33 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | -1929.70 ± 1.20 | kJ/mol | NIST |
| ΔfusH° | 45.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 160.93 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.39 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.15 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.178 | Crippen Calculated Property | |
| McVol | 179.290 | ml/mol | McGowan Calculated Property |
| Pc | 6631.37 | kPa | Joback Calculated Property |
| Tboil | 591.76 | K | Relay (1.0) Calculated Property |
| Tc | 1086.17 | K | Relay (1.0) Calculated Property |
| Tfus | 496.32 | K | Relay (1.0) Calculated Property |
| Vc | 0.633 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [492.55; 509.21] | J/mol×K | [1227.93; 1550.54] | 
|
| Cp,gas | 509.15 | J/mol×K | 1227.93 | Joback Calculated Property |
| Cp,gas | 509.21 | J/mol×K | 1281.70 | Joback Calculated Property |
| Cp,gas | 508.08 | J/mol×K | 1335.47 | Joback Calculated Property |
| Cp,gas | 505.80 | J/mol×K | 1389.24 | Joback Calculated Property |
| Cp,gas | 502.42 | J/mol×K | 1443.00 | Joback Calculated Property |
| Cp,gas | 497.99 | J/mol×K | 1496.77 | Joback Calculated Property |
| Cp,gas | 492.55 | J/mol×K | 1550.54 | Joback Calculated Property |
| η | [2.7261549e-09; 0.0000002] | Pa×s | [843.98; 1227.93] |
|
| η | 0.0000002 | Pa×s | 843.98 | Joback Calculated Property |
| η | 6.4112602e-08 | Pa×s | 907.97 | Joback Calculated Property |
| η | 2.8869119e-08 | Pa×s | 971.96 | Joback Calculated Property |
| η | 1.4346038e-08 | Pa×s | 1035.95 | Joback Calculated Property |
| η | 7.7333442e-09 | Pa×s | 1099.95 | Joback Calculated Property |
| η | 4.4618126e-09 | Pa×s | 1163.94 | Joback Calculated Property |
| η | 2.7261549e-09 | Pa×s | 1227.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzenepentacarboxylic acid.
Sources
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