- InChI
- InChI=1S/C14H9NO2/c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16/h1-7H,15H2
- InChI Key
- KHUFHLFHOQVFGB-UHFFFAOYSA-N
- Formula
- C14H9NO2
- SMILES
- Nc1cccc2c1C(=O)c1ccccc1C2=O
- Molecular Weight1
- 223.23
- CAS
- 82-45-1
- Other Names
-
- 1-Amino-9,10-anthraquinone
- 1-Aminoanthrachinon
- 1-amino-9,10-anthracenedione
- 1-aminoanthraquinone
- 9,10-Dioxo-9,10-dihydro-1-anthraceneamine
- C.I. 37275
- Diazo Fast Red AL
- NSC 30415
- NSC 458
- Smoke Orange G
- anthraquinone, 1-amino-
- «alpha»-Aminoanthraquinone
- «alpha»-Anthraquinonylamine
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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).
- Inp : Non-polar retention indices.
- 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° | 164.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -35.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.48 | kJ/mol | Joback Calculated Property |
| log10WS | -3.27 | Crippen Calculated Property | |
| logPoct/wat | 2.044 | Crippen Calculated Property | |
| McVol | 162.860 | ml/mol | McGowan Calculated Property |
| Pc | 3543.08 | kPa | Joback Calculated Property |
| Inp | [380.00; 386.00] |
|
|
| Inp | 380.00 | NIST | |
| Inp | 383.68 | NIST | |
| Inp | 384.41 | NIST | |
| Inp | 386.00 | NIST | |
| Tboil | 803.33 | K | Joback Calculated Property |
| Tc | 1081.85 | K | Joback Calculated Property |
| Tfus | 583.34 | K | Joback Calculated Property |
| Vc | 0.613 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [455.33; 513.96] | J/mol×K | [803.33; 1081.85] |
|
| Cp,gas | 455.33 | J/mol×K | 803.33 | Joback Calculated Property |
| Cp,gas | 468.05 | J/mol×K | 849.75 | Joback Calculated Property |
| Cp,gas | 479.54 | J/mol×K | 896.17 | Joback Calculated Property |
| Cp,gas | 489.82 | J/mol×K | 942.59 | Joback Calculated Property |
| Cp,gas | 498.96 | J/mol×K | 989.01 | Joback Calculated Property |
| Cp,gas | 506.99 | J/mol×K | 1035.43 | Joback Calculated Property |
| Cp,gas | 513.96 | J/mol×K | 1081.85 | Joback Calculated Property |
| ΔfusH | [28.78; 28.78] | kJ/mol | [524.20; 524.20] |
|
| ΔfusH | 28.78 | kJ/mol | 524.20 | NIST |
| ΔfusH | 28.78 | kJ/mol | 524.20 | NIST |
| ΔsubH | [103.30; 126.50] | kJ/mol | [380.50; 513.00] |
|
| ΔsubH | 116.30 ± 3.90 | kJ/mol | 380.50 | NIST |
| ΔsubH | 126.50 | kJ/mol | 428.00 | NIST |
| ΔsubH | 113.00 ± 0.40 | kJ/mol | 463.00 | NIST |
| ΔsubH | 103.30 | kJ/mol | 513.00 | NIST |
Similar Compounds
Find more compounds similar to 9,10-Anthracenedione, 1-amino-.
Mixtures
Sources
- Crippen Method
- Crippen Method
- Solubility of 1-aminoanthraquinone and 1-nitroanthraquinone in supercritical carbon dioxide
- Joback Method
- McGowan Method
- NIST Webbook
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