- InChI
- InChI=1S/C14H28N2O4/c1-11(2)9-19-13(17)15-7-5-6-8-16-14(18)20-10-12(3)4/h11-12H,5-10H2,1-4H3,(H,15,17)(H,16,18)
- InChI Key
- YVGVGACZXWMVSU-UHFFFAOYSA-N
- Formula
- C14H28N2O4
- SMILES
- CC(C)COC(=O)NCCCCNC(=O)OCC(C)C
- Molecular Weight1
- 288.38
- 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).
- Inp : Non-polar retention indices.
- 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° | -226.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -725.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.17 | kJ/mol | Joback Calculated Property |
| log10WS | -3.26 | Crippen Calculated Property | |
| logPoct/wat | 2.531 | Crippen Calculated Property | |
| McVol | 242.960 | ml/mol | McGowan Calculated Property |
| Pc | 1696.30 | kPa | Joback Calculated Property |
| Inp | 2154.00 | NIST | |
| Tboil | 771.76 | K | Joback Calculated Property |
| Tc | 959.40 | K | Joback Calculated Property |
| Tfus | 467.18 | K | Joback Calculated Property |
| Vc | 0.925 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [740.77; 818.80] | J/mol×K | [771.76; 959.40] | 
|
| Cp,gas | 740.77 | J/mol×K | 771.76 | Joback Calculated Property |
| Cp,gas | 756.03 | J/mol×K | 803.03 | Joback Calculated Property |
| Cp,gas | 770.38 | J/mol×K | 834.31 | Joback Calculated Property |
| Cp,gas | 783.82 | J/mol×K | 865.58 | Joback Calculated Property |
| Cp,gas | 796.36 | J/mol×K | 896.85 | Joback Calculated Property |
| Cp,gas | 808.02 | J/mol×K | 928.13 | Joback Calculated Property |
| Cp,gas | 818.80 | J/mol×K | 959.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Putrescine, bis-isoBOC.
Sources
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