- InChI
- InChI=1S/C6H11NO4/c1-3-10-5(8)7-6(9)11-4-2/h3-4H2,1-2H3,(H,7,8,9)
- InChI Key
- PQVSTLUFSYVLTO-UHFFFAOYSA-N
- Formula
- C6H11NO4
- SMILES
- CCOC(=O)N=C(O)OCC
- Molecular Weight1
- 161.16
- CAS
- 19617-44-8
- ΔfH°gas : Enthalpy of formation 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -623.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.59 | kJ/mol | Joback Calculated Property |
| log10WS | -0.74 | Crippen Calculated Property | |
| logPoct/wat | 1.093 | Crippen Calculated Property | |
| McVol | 120.260 | ml/mol | McGowan Calculated Property |
| Pc | 3181.14 | kPa | Joback Calculated Property |
| Tboil | 499.20 | K | NIST |
| Tc | 792.57 | K | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 406.00 ± 1.00 | K | 2.00 | NIST |
Similar Compounds
Find more compounds similar to Imidodicarbonic acid, diethyl ester.
Sources
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