- InChI
- InChI=1S/C3H4N2O/c4-1-2-5-3-6/h3H,2H2,(H,5,6)
- InChI Key
- HHENWUYAOCBSAE-UHFFFAOYSA-N
- Formula
- C3H4N2O
- SMILES
- N#CCNC=O
- Molecular Weight1
- 84.08
- CAS
- 5018-27-9
- ω : Acentric Factor.
- 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).
- 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 | 0.4910 | Relay (1.0) Calculated Property | |
| ΔfG° | 97.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -15.58 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.41 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.744 | Crippen Calculated Property | |
| McVol | 66.060 | ml/mol | McGowan Calculated Property |
| Pc | 4795.85 | kPa | Joback Calculated Property |
| Tboil | 517.13 | K | Relay (1.0) Calculated Property |
| Tc | 706.52 | K | Relay (1.0) Calculated Property |
| Tfus | 283.79 | K | Relay (1.0) Calculated Property |
| Vc | 0.257 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [125.74; 152.14] | J/mol×K | [468.95; 673.13] | 
|
| Cp,gas | 125.74 | J/mol×K | 468.95 | Joback Calculated Property |
| Cp,gas | 130.75 | J/mol×K | 502.98 | Joback Calculated Property |
| Cp,gas | 135.52 | J/mol×K | 537.01 | Joback Calculated Property |
| Cp,gas | 140.03 | J/mol×K | 571.04 | Joback Calculated Property |
| Cp,gas | 144.30 | J/mol×K | 605.07 | Joback Calculated Property |
| Cp,gas | 148.33 | J/mol×K | 639.10 | Joback Calculated Property |
| Cp,gas | 152.14 | J/mol×K | 673.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Formamide, N-(cyanomethyl)-.
Sources
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