- InChI
- InChI=1S/C5H10N2/c1-5(2)3-6-4-7-5/h4H,3H2,1-2H3,(H,6,7)
- InChI Key
- OVABIFHEPZPSCK-UHFFFAOYSA-N
- Formula
- C5H10N2
- SMILES
- CC1(C)CN=CN1
- Molecular Weight1
- 98.15
- CAS
- 2305-59-1
- ω : Acentric Factor.
- 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).
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 | 0.3178 | Relay (1.0) Calculated Property | |
| PAff | 988.10 | kJ/mol | NIST |
| BasG | 955.70 | kJ/mol | NIST |
| ΔfG° | 256.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 32.70 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.43 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.89 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.396 | Crippen Calculated Property | |
| McVol | 86.110 | ml/mol | McGowan Calculated Property |
| Pc | 5022.80 | kPa | Joback Calculated Property |
| Tboil | 448.56 | K | Relay (1.0) Calculated Property |
| Tc | 626.80 | K | Relay (1.0) Calculated Property |
| Tfus | 305.15 | K | Relay (1.0) Calculated Property |
| Vc | 0.313 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [175.45; 246.70] | J/mol×K | [430.73; 664.32] | 
|
| Cp,gas | 175.45 | J/mol×K | 430.73 | Joback Calculated Property |
| Cp,gas | 189.57 | J/mol×K | 469.66 | Joback Calculated Property |
| Cp,gas | 202.66 | J/mol×K | 508.59 | Joback Calculated Property |
| Cp,gas | 214.81 | J/mol×K | 547.52 | Joback Calculated Property |
| Cp,gas | 226.13 | J/mol×K | 586.46 | Joback Calculated Property |
| Cp,gas | 236.72 | J/mol×K | 625.39 | Joback Calculated Property |
| Cp,gas | 246.70 | J/mol×K | 664.32 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 355.70 | K | 2.00 | NIST |
Similar Compounds
Find more compounds similar to 4,4-Dimethyl-2-imidazoline.
Sources
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