- InChI
- InChI=1S/C12H8Cl3NO/c13-12(14,15)11(17)16-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H,16,17)
- InChI Key
- FEXNJZJFISBCHC-UHFFFAOYSA-N
- Formula
- C12H8Cl3NO
- SMILES
-
O=C(Nc1cccc2ccccc12)C(Cl)(Cl)C
l - Molecular Weight1
- 288.56
- ω : Acentric Factor.
- 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).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.5090 | Relay (... Calculated Property | |
| ΔfG° | 187.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -76.97 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 29.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.39 | kJ/mol | Relay (... Calculated Property |
| IE | 8.16 | eV | Relay (... Calculated Property |
| log10WS | -4.77 | Relay (... Calculated Property | |
| logPoct/wat | 4.149 | Crippen Calculated Property | |
| McVol | 184.990 | ml/mol | McGowan Calculated Property |
| Pc | 3002.44 | kPa | Joback Calculated Property |
| Inp | [2125.00; 2125.00] |
|
|
| Inp | 2125.00 | NIST | |
| Inp | 2125.00 | NIST | |
| Tboil | 636.06 | K | Relay (... Calculated Property |
| Tc | 947.07 | K | Relay (... Calculated Property |
| Tfus | 372.46 | K | Relay (... Calculated Property |
| Vc | 0.639 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [429.29; 477.72] | J/mol×K | [737.70; 996.42] |
|
| Cp,gas | 429.29 | J/mol×K | 737.70 | Joback Calculated Property |
| Cp,gas | 439.26 | J/mol×K | 780.82 | Joback Calculated Property |
| Cp,gas | 448.27 | J/mol×K | 823.94 | Joback Calculated Property |
| Cp,gas | 456.46 | J/mol×K | 867.06 | Joback Calculated Property |
| Cp,gas | 464.00 | J/mol×K | 910.18 | Joback Calculated Property |
| Cp,gas | 471.04 | J/mol×K | 953.30 | Joback Calculated Property |
| Cp,gas | 477.72 | J/mol×K | 996.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetamide, N-(1-naphthyl)-2,2,2-trichloro-.
Sources
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