- InChI
- InChI=1S/C3H6N2/c1-5-3-2-4/h5H,3H2,1H3
- InChI Key
- PVVRRUUMHFWFQV-UHFFFAOYSA-N
- Formula
- C3H6N2
- SMILES
- CNCC#N
- Molecular Weight1
- 70.09
- CAS
- 5616-32-0
- Other Names
-
- Methylaminoacetonitrile
- Acetonitrile, (methylamino)-
- Glycinonitrile, N-methyl-
- N-Methylaminoacetonitrile
- Sarcosinonitrile
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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 |
|---|---|---|---|
| PAff | 863.80 | kJ/mol | NIST |
| BasG | 830.70 | kJ/mol | NIST |
| ΔfG° | 196.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 113.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 10.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.19 | kJ/mol | Joback Calculated Property |
| log10WS | -0.13 | Crippen Calculated Property | |
| logPoct/wat | -0.271 | Crippen Calculated Property | |
| McVol | 64.490 | ml/mol | McGowan Calculated Property |
| Pc | 4339.67 | kPa | Joback Calculated Property |
| Tboil | 420.29 | K | Joback Calculated Property |
| Tc | 618.43 | K | Joback Calculated Property |
| Tfus | 241.22 | K | Joback Calculated Property |
| Vc | 0.265 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [116.36; 148.11] | J/mol×K | [420.29; 618.43] | 
|
| Cp,gas | 116.36 | J/mol×K | 420.29 | Joback Calculated Property |
| Cp,gas | 122.27 | J/mol×K | 453.31 | Joback Calculated Property |
| Cp,gas | 127.93 | J/mol×K | 486.34 | Joback Calculated Property |
| Cp,gas | 133.34 | J/mol×K | 519.36 | Joback Calculated Property |
| Cp,gas | 138.50 | J/mol×K | 552.38 | Joback Calculated Property |
| Cp,gas | 143.42 | J/mol×K | 585.41 | Joback Calculated Property |
| Cp,gas | 148.11 | J/mol×K | 618.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to CH3NHCH2CN.
Sources
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