- InChI
- InChI=1S/C19H33NO2S/c1-4-6-7-8-9-10-11-12-17-20(5-2)23(21,22)19-15-13-18(3)14-16-19/h13-16H,4-12,17H2,1-3H3
- InChI Key
- WXPHJAAOAQOVFF-UHFFFAOYSA-N
- Formula
- C19H33NO2S
- SMILES
-
CCCCCCCCCCN(CC)S(=O)(=O)c1ccc(
C)cc1 - Molecular Weight1
- 339.54
- 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 | 0.8716 | Relay (1.0) Calculated Property | |
| ΔfG° | -145.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -465.04 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 53.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.146 | Crippen Calculated Property | |
| McVol | 292.880 | ml/mol | McGowan Calculated Property |
| Pc | 1510.50 | kPa | Joback Calculated Property |
| Inp | [2781.00; 2781.00] |
|
|
| Inp | 2781.00 | NIST | |
| Inp | 2781.00 | NIST | |
| Tboil | 672.98 | K | Relay (1.0) Calculated Property |
| Tc | 866.59 | K | Relay (1.0) Calculated Property |
| Tfus | 329.61 | K | Relay (1.0) Calculated Property |
| Vc | 1.077 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [850.12; 948.75] | J/mol×K | [726.00; 908.32] |
|
| Cp,gas | 850.12 | J/mol×K | 726.00 | Joback Calculated Property |
| Cp,gas | 869.18 | J/mol×K | 756.39 | Joback Calculated Property |
| Cp,gas | 887.14 | J/mol×K | 786.77 | Joback Calculated Property |
| Cp,gas | 904.05 | J/mol×K | 817.16 | Joback Calculated Property |
| Cp,gas | 919.94 | J/mol×K | 847.55 | Joback Calculated Property |
| Cp,gas | 934.82 | J/mol×K | 877.93 | Joback Calculated Property |
| Cp,gas | 948.75 | J/mol×K | 908.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzenesulfonamide, 4-methyl-N-ethyl-N-decyl-.
Sources
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