- InChI
- InChI=1S/C15H9ClO2/c1-8-6-7-11-12(13(8)16)15(18)10-5-3-2-4-9(10)14(11)17/h2-7H,1H3
- InChI Key
- NMFBXBSNLQNQKL-UHFFFAOYSA-N
- Formula
- C15H9ClO2
- SMILES
-
Cc1ccc2c(c1Cl)C(=O)c1ccccc1C2=
O - Molecular Weight1
- 256.68
- CAS
- 129-35-1
- 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).
- 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° | 85.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -117.59 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.11 | kJ/mol | Joback Calculated Property |
| log10WS | -4.79 | Crippen Calculated Property | |
| logPoct/wat | 3.424 | Crippen Calculated Property | |
| McVol | 179.210 | ml/mol | McGowan Calculated Property |
| Pc | 2814.34 | kPa | Joback Calculated Property |
| Tboil | 796.09 | K | Joback Calculated Property |
| Tc | 1067.15 | K | Joback Calculated Property |
| Tfus | 553.79 | K | Joback Calculated Property |
| Vc | 0.689 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [472.46; 533.12] | J/mol×K | [796.09; 1067.15] | 
|
| Cp,gas | 472.46 | J/mol×K | 796.09 | Joback Calculated Property |
| Cp,gas | 485.43 | J/mol×K | 841.27 | Joback Calculated Property |
| Cp,gas | 497.22 | J/mol×K | 886.44 | Joback Calculated Property |
| Cp,gas | 507.85 | J/mol×K | 931.62 | Joback Calculated Property |
| Cp,gas | 517.36 | J/mol×K | 976.80 | Joback Calculated Property |
| Cp,gas | 525.77 | J/mol×K | 1021.97 | Joback Calculated Property |
| Cp,gas | 533.12 | J/mol×K | 1067.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Chloro-2-methylanthraquinone.
Sources
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