- InChI
- InChI=1S/C15H31NO2/c1-4-5-6-7-8-9-10-11-12-16-15(17)18-13-14(2)3/h14H,4-13H2,1-3H3,(H,16,17)
- InChI Key
- XUFMMPHELKDXCI-UHFFFAOYSA-N
- Formula
- C15H31NO2
- SMILES
- CCCCCCCCCCNC(=O)OCC(C)C
- Molecular Weight1
- 257.41
- 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° | -71.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -549.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.19 | kJ/mol | Joback Calculated Property |
| log10WS | -4.89 | Crippen Calculated Property | |
| logPoct/wat | 4.509 | Crippen Calculated Property | |
| McVol | 239.630 | ml/mol | McGowan Calculated Property |
| Pc | 1489.58 | kPa | Joback Calculated Property |
| Inp | 1881.00 | NIST | |
| Tboil | 668.62 | K | Joback Calculated Property |
| Tc | 841.93 | K | Joback Calculated Property |
| Tfus | 368.63 | K | Joback Calculated Property |
| Vc | 0.928 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [683.08; 775.94] | J/mol×K | [668.62; 841.93] | 
|
| Cp,gas | 683.08 | J/mol×K | 668.62 | Joback Calculated Property |
| Cp,gas | 700.49 | J/mol×K | 697.50 | Joback Calculated Property |
| Cp,gas | 717.11 | J/mol×K | 726.39 | Joback Calculated Property |
| Cp,gas | 732.95 | J/mol×K | 755.27 | Joback Calculated Property |
| Cp,gas | 748.02 | J/mol×K | 784.16 | Joback Calculated Property |
| Cp,gas | 762.34 | J/mol×K | 813.04 | Joback Calculated Property |
| Cp,gas | 775.94 | J/mol×K | 841.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isobutylcarbamate, N-decyl.
Sources
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