- InChI
- InChI=1S/C8H16N2O3/c1-10(2)6-9-7(5-12-3)8(11)13-4/h6-7H,5H2,1-4H3
- InChI Key
- HPRPLWMMVVDNMT-UHFFFAOYSA-N
- Formula
- C8H16N2O3
- SMILES
- COCC(N=CN(C)C)C(=O)OC
- Molecular Weight1
- 188.22
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.5476 | Relay (1.0) Calculated Property | |
| ΔfG° | -105.13 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -451.80 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 71.01 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.85 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.02 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.236 | Crippen Calculated Property | |
| McVol | 152.550 | ml/mol | McGowan Calculated Property |
| Pc | 2365.67 | kPa | Joback Calculated Property |
| Inp | [1354.00; 1354.00] |
|
|
| Inp | 1354.00 | NIST | |
| Inp | 1354.00 | NIST | |
| Tboil | 532.42 | K | Relay (1.0) Calculated Property |
| Tc | 689.93 | K | Relay (1.0) Calculated Property |
| Tfus | 270.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.546 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to O-Methyl-DL-serine, N-dimethylaminomethylene-, methyl ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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