- InChI
- InChI=1S/C5H11NO2/c1-4(2)8-5(7)6-3/h4H,1-3H3,(H,6,7)
- InChI Key
- ZLQUUMARLOVRLO-UHFFFAOYSA-N
- Formula
- C5H11NO2
- SMILES
- CNC(=O)OC(C)C
- Molecular Weight1
- 117.15
- Other Names
-
- Isopropyl N-methyl carbamate
- 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.
- I : 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° | -155.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -343.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.93 | kJ/mol | Joback Calculated Property |
| log10WS | -1.06 | Crippen Calculated Property | |
| logPoct/wat | 0.751 | Crippen Calculated Property | |
| McVol | 98.730 | ml/mol | McGowan Calculated Property |
| Pc | 3759.17 | kPa | Joback Calculated Property |
| Inp | [908.00; 908.00] |
|
|
| Inp | 908.00 | NIST | |
| Inp | 908.00 | NIST | |
| I | [1428.00; 1428.00] |
|
|
| I | 1428.00 | NIST | |
| I | 1428.00 | NIST | |
| Tboil | 439.82 | K | Joback Calculated Property |
| Tc | 626.93 | K | Joback Calculated Property |
| Tfus | 255.93 | K | Joback Calculated Property |
| Vc | 0.368 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [201.51; 254.52] | J/mol×K | [439.82; 626.93] |
|
| Cp,gas | 201.51 | J/mol×K | 439.82 | Joback Calculated Property |
| Cp,gas | 211.21 | J/mol×K | 471.00 | Joback Calculated Property |
| Cp,gas | 220.57 | J/mol×K | 502.19 | Joback Calculated Property |
| Cp,gas | 229.58 | J/mol×K | 533.37 | Joback Calculated Property |
| Cp,gas | 238.24 | J/mol×K | 564.56 | Joback Calculated Property |
| Cp,gas | 246.55 | J/mol×K | 595.74 | Joback Calculated Property |
| Cp,gas | 254.52 | J/mol×K | 626.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbamic acid, methyl, isopropyl ester.
Sources
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