- InChI
- InChI=1S/C3H8N2O3/c4-3(8)5(1-6)2-7/h6-7H,1-2H2,(H2,4,8)
- InChI Key
- QAGFPFWZCJWYRP-UHFFFAOYSA-N
- Formula
- C3H8N2O3
- SMILES
- NC(=O)N(CO)CO
- Molecular Weight1
- 120.11
- CAS
- 25155-29-7
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (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).
- ΔfH°solid : Solid phase 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 | 0.8413 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -1606.80 | kJ/mol | NIST |
| ΔfG° | -250.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -553.78 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | -717.05 | kJ/mol | NIST |
| ΔfusH° | 21.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.56 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | -1.733 | Crippen Calculated Property | |
| McVol | 86.400 | ml/mol | McGowan Calculated Property |
| Pc | 6898.38 | kPa | Joback Calculated Property |
| Tboil | 562.15 | K | Relay (1.0) Calculated Property |
| Tc | 829.84 | K | Relay (1.0) Calculated Property |
| Tfus | 378.42 | K | Relay (1.0) Calculated Property |
| Vc | 0.320 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [217.43; 247.89] | J/mol×K | [591.24; 768.26] | 
|
| Cp,gas | 217.43 | J/mol×K | 591.24 | Joback Calculated Property |
| Cp,gas | 223.25 | J/mol×K | 620.74 | Joback Calculated Property |
| Cp,gas | 228.76 | J/mol×K | 650.25 | Joback Calculated Property |
| Cp,gas | 233.97 | J/mol×K | 679.75 | Joback Calculated Property |
| Cp,gas | 238.88 | J/mol×K | 709.25 | Joback Calculated Property |
| Cp,gas | 243.52 | J/mol×K | 738.75 | Joback Calculated Property |
| Cp,gas | 247.89 | J/mol×K | 768.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to bis(hydroxymethyl)urea.
Sources
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