- InChI
- InChI=1S/C11H23NO2/c1-4-5-6-7-8-12-11(13)14-9-10(2)3/h10H,4-9H2,1-3H3,(H,12,13)
- InChI Key
- FTGWBFMEPQSPAF-UHFFFAOYSA-N
- Formula
- C11H23NO2
- SMILES
- CCCCCCNC(=O)OCC(C)C
- Molecular Weight1
- 201.31
- 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° | -105.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -466.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.28 | kJ/mol | Joback Calculated Property |
| log10WS | -3.22 | Crippen Calculated Property | |
| logPoct/wat | 2.949 | Crippen Calculated Property | |
| McVol | 183.270 | ml/mol | McGowan Calculated Property |
| Pc | 2053.03 | kPa | Joback Calculated Property |
| Inp | 1486.00 | NIST | |
| Tboil | 577.10 | K | Joback Calculated Property |
| Tc | 753.70 | K | Joback Calculated Property |
| Tfus | 323.55 | K | Joback Calculated Property |
| Vc | 0.705 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [470.14; 552.57] | J/mol×K | [577.10; 753.70] | 
|
| Cp,gas | 470.14 | J/mol×K | 577.10 | Joback Calculated Property |
| Cp,gas | 485.47 | J/mol×K | 606.53 | Joback Calculated Property |
| Cp,gas | 500.16 | J/mol×K | 635.97 | Joback Calculated Property |
| Cp,gas | 514.20 | J/mol×K | 665.40 | Joback Calculated Property |
| Cp,gas | 527.61 | J/mol×K | 694.84 | Joback Calculated Property |
| Cp,gas | 540.39 | J/mol×K | 724.27 | Joback Calculated Property |
| Cp,gas | 552.57 | J/mol×K | 753.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isobutylcarbamate, N-hexyl.
Sources
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