- InChI
- InChI=1S/C15H10O2/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H,(H,16,17)
- InChI Key
- XGWFJBFNAQHLEF-UHFFFAOYSA-N
- Formula
- C15H10O2
- SMILES
- O=C(O)c1c2ccccc2cc2ccccc12
- Molecular Weight1
- 222.24
- CAS
- 723-62-6
- Other Names
-
- 9-anthroic acid
- 9-carboxyanthracene
- ANCA
- Anthracene-10-carboxylic acid
- Anthracene-9-carboxylic acid
- 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).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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).
- Psub : Sublimation 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 |
|---|---|---|---|
| ΔfG° | 116.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -22.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.29 | kJ/mol | Joback Calculated Property |
| log10WS | -5.14 | Crippen Calculated Property | |
| logPoct/wat | 3.691 | Crippen Calculated Property | |
| McVol | 166.970 | ml/mol | McGowan Calculated Property |
| Pc | 3411.87 | kPa | Joback Calculated Property |
| Tboil | 763.25 | K | Joback Calculated Property |
| Tc | 996.23 | K | Joback Calculated Property |
| Tfus | 486.42 | K | Joback Calculated Property |
| Vc | 0.636 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [440.49; 493.96] | J/mol×K | [763.25; 996.23] | 
|
|
T(K) Ideal gas heat capacity (J/mol×K) 440 450 460 470 480 490 800 900 1000 | ||||
| Cp,gas | 440.49 | J/mol×K | 763.25 | Joback Calculated Property |
| Cp,gas | 450.84 | J/mol×K | 802.08 | Joback Calculated Property |
| Cp,gas | 460.47 | J/mol×K | 840.91 | Joback Calculated Property |
| Cp,gas | 469.49 | J/mol×K | 879.74 | Joback Calculated Property |
| Cp,gas | 478.01 | J/mol×K | 918.57 | Joback Calculated Property |
| Cp,gas | 486.13 | J/mol×K | 957.40 | Joback Calculated Property |
| Cp,gas | 493.96 | J/mol×K | 996.23 | Joback Calculated Property |
| η | [0.0001233; 0.0011761] | Pa×s | [486.42; 763.25] |
|
|
T(K) Dynamic viscosity (Pa×s) 2.00e-4 4.00e-4 6.00e-4 8.00e-4 1.00e-3 1.20e-3 500 600 700 | ||||
| η | 0.0011761 | Pa×s | 486.42 | Joback Calculated Property |
| η | 0.0006863 | Pa×s | 532.56 | Joback Calculated Property |
| η | 0.0004364 | Pa×s | 578.70 | Joback Calculated Property |
| η | 0.0002967 | Pa×s | 624.84 | Joback Calculated Property |
| η | 0.0002127 | Pa×s | 670.97 | Joback Calculated Property |
| η | 0.0001591 | Pa×s | 717.11 | Joback Calculated Property |
| η | 0.0001233 | Pa×s | 763.25 | Joback Calculated Property |
| ΔsubH | 120.10 ± 3.80 | kJ/mol | 402.50 | NIST |
| Psub | [1.75e-04; 1.19e-03] | kPa | [403.16; 423.12] |
|
|
T(K) Sublimation pressure (kPa) 2.00e-4 4.00e-4 6.00e-4 8.00e-4 1.00e-3 1.20e-3 405 410 415 420 | ||||
| Psub | 1.80e-04 | kPa | 403.16 | Thermod... |
| Psub | 1.80e-04 | kPa | 403.16 | Thermod... |
| Psub | 1.75e-04 | kPa | 403.16 | Thermod... |
| Psub | 2.18e-04 | kPa | 405.12 | Thermod... |
| Psub | 2.15e-04 | kPa | 405.12 | Thermod... |
| Psub | 2.12e-04 | kPa | 405.12 | Thermod... |
| Psub | 2.72e-04 | kPa | 407.14 | Thermod... |
| Psub | 2.55e-04 | kPa | 407.14 | Thermod... |
| Psub | 2.49e-04 | kPa | 407.14 | Thermod... |
| Psub | 3.21e-04 | kPa | 409.18 | Thermod... |
| Psub | 3.12e-04 | kPa | 409.18 | Thermod... |
| Psub | 3.79e-04 | kPa | 411.14 | Thermod... |
| Psub | 3.78e-04 | kPa | 411.14 | Thermod... |
| Psub | 3.68e-04 | kPa | 411.14 | Thermod... |
| Psub | 4.70e-04 | kPa | 413.14 | Thermod... |
| Psub | 4.47e-04 | kPa | 413.14 | Thermod... |
| Psub | 4.44e-04 | kPa | 413.14 | Thermod... |
| Psub | 5.76e-04 | kPa | 415.19 | Thermod... |
| Psub | 5.50e-04 | kPa | 415.19 | Thermod... |
| Psub | 5.55e-04 | kPa | 415.19 | Thermod... |
| Psub | 6.78e-04 | kPa | 417.15 | Thermod... |
| Psub | 6.68e-04 | kPa | 417.15 | Thermod... |
| Psub | 6.48e-04 | kPa | 417.15 | Thermod... |
| Psub | 8.20e-04 | kPa | 419.14 | Thermod... |
| Psub | 8.37e-04 | kPa | 419.14 | Thermod... |
| Psub | 8.16e-04 | kPa | 419.14 | Thermod... |
| Psub | 1.00e-03 | kPa | 421.19 | Thermod... |
| Psub | 9.97e-04 | kPa | 421.19 | Thermod... |
| Psub | 9.97e-04 | kPa | 421.19 | Thermod... |
| Psub | 1.19e-03 | kPa | 423.12 | Thermod... |
| Psub | 1.18e-03 | kPa | 423.12 | Thermod... |
| Psub | 1.15e-03 | kPa | 423.12 | Thermod... |
Similar Compounds
Find more compounds similar to 9-Anthracenecarboxylic acid.
Sources
- Crippen Method
- Crippen Method
- Thermodynamic study of 9-anthracenecarboxylic acid
- Joback Method
- McGowan Method
- NIST Webbook
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