- InChI
- InChI=1S/C6H11NO5/c1-5(2)3-11-6(8)4-12-7(9)10/h5H,3-4H2,1-2H3
- InChI Key
- CKQILHWPHPTJBO-UHFFFAOYSA-N
- Formula
- C6H11NO5
- SMILES
- CC(C)COC(=O)CO[N+](=O)[O-]
- Molecular Weight1
- 177.16
- 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).
- 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° | -306.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -560.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.72 | kJ/mol | Joback Calculated Property |
| log10WS | -1.12 | Crippen Calculated Property | |
| logPoct/wat | 0.394 | Crippen Calculated Property | |
| McVol | 126.130 | ml/mol | McGowan Calculated Property |
| Pc | 3284.05 | kPa | Joback Calculated Property |
| Tboil | 586.79 | K | Joback Calculated Property |
| Tc | 797.60 | K | Joback Calculated Property |
| Tfus | 380.38 | K | Joback Calculated Property |
| Vc | 0.489 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [310.17; 366.95] | J/mol×K | [586.79; 797.60] | 
|
| Cp,gas | 310.17 | J/mol×K | 586.79 | Joback Calculated Property |
| Cp,gas | 321.01 | J/mol×K | 621.92 | Joback Calculated Property |
| Cp,gas | 331.31 | J/mol×K | 657.06 | Joback Calculated Property |
| Cp,gas | 341.06 | J/mol×K | 692.19 | Joback Calculated Property |
| Cp,gas | 350.26 | J/mol×K | 727.33 | Joback Calculated Property |
| Cp,gas | 358.89 | J/mol×K | 762.46 | Joback Calculated Property |
| Cp,gas | 366.95 | J/mol×K | 797.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glycolic acid, nitrate, isobutyl ester.
Sources
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