- InChI
- InChI=1S/C4H8N2O2/c1-2(3(5)7)4(6)8/h2H,1H3,(H2,5,7)(H2,6,8)
- InChI Key
- CGRKYGKHZOCPSZ-UHFFFAOYSA-N
- Formula
- C4H8N2O2
- SMILES
- CC(C(N)=O)C(N)=O
- Molecular Weight1
- 116.12
- CAS
- 1113-63-9
- Other Names
-
- 2-Methylmalonamide
- 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° | -144.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -288.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.88 | kJ/mol | Joback Calculated Property |
| log10WS | 0.33 | Crippen Calculated Property | |
| logPoct/wat | -1.407 | Crippen Calculated Property | |
| McVol | 90.320 | ml/mol | McGowan Calculated Property |
| Pc | 5454.60 | kPa | Joback Calculated Property |
| Tboil | 543.28 | K | Joback Calculated Property |
| Tc | 765.60 | K | Joback Calculated Property |
| Tfus | 386.22 | K | Joback Calculated Property |
| Vc | 0.324 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [207.49; 248.99] | J/mol×K | [543.28; 765.60] | 
|
| Cp,gas | 207.49 | J/mol×K | 543.28 | Joback Calculated Property |
| Cp,gas | 215.58 | J/mol×K | 580.33 | Joback Calculated Property |
| Cp,gas | 223.19 | J/mol×K | 617.39 | Joback Calculated Property |
| Cp,gas | 230.32 | J/mol×K | 654.44 | Joback Calculated Property |
| Cp,gas | 236.99 | J/mol×K | 691.49 | Joback Calculated Property |
| Cp,gas | 243.21 | J/mol×K | 728.54 | Joback Calculated Property |
| Cp,gas | 248.99 | J/mol×K | 765.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methylmalonodiamide.
Sources
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