- InChI
- InChI=1S/C15H10O2/c1-9-5-4-8-12-13(9)15(17)11-7-3-2-6-10(11)14(12)16/h2-8H,1H3
- InChI Key
- RBGUKBSLNOTVCD-UHFFFAOYSA-N
- Formula
- C15H10O2
- SMILES
- Cc1cccc2c1C(=O)c1ccccc1C2=O
- Molecular Weight1
- 222.24
- CAS
- 954-07-4
- Other Names
-
- Anthraquinone, 1-methyl-
- «alpha»-Methylanthraquinone
- 1-Methyl-9,10-anthraquinone
- 1-Methylanthraquinone
- Antracene-9,10(9H,10H)-dione, 1-methyl-
- 1-Methylanthracenedione
- 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).
- 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° | 106.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -90.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.07 | kJ/mol | Joback Calculated Property |
| log10WS | -4.11 | Crippen Calculated Property | |
| logPoct/wat | 2.770 | Crippen Calculated Property | |
| McVol | 166.970 | ml/mol | McGowan Calculated Property |
| Pc | 2976.29 | kPa | Joback Calculated Property |
| Inp | 344.50 | NIST | |
| Tboil | 753.68 | K | Joback Calculated Property |
| Tc | 1022.79 | K | Joback Calculated Property |
| Tfus | 511.35 | K | Joback Calculated Property |
| Vc | 0.639 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [452.00; 520.84] | J/mol×K | [753.68; 1022.79] | 
|
| Cp,gas | 452.00 | J/mol×K | 753.68 | Joback Calculated Property |
| Cp,gas | 466.44 | J/mol×K | 798.53 | Joback Calculated Property |
| Cp,gas | 479.63 | J/mol×K | 843.38 | Joback Calculated Property |
| Cp,gas | 491.63 | J/mol×K | 888.23 | Joback Calculated Property |
| Cp,gas | 502.47 | J/mol×K | 933.09 | Joback Calculated Property |
| Cp,gas | 512.19 | J/mol×K | 977.94 | Joback Calculated Property |
| Cp,gas | 520.84 | J/mol×K | 1022.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9,10-Anthracenedione, 1-methyl-.
Sources
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