- InChI
- InChI=1S/C14H21NO/c1-2-15-13(14-9-6-10-16-14)11-12-7-4-3-5-8-12/h3-5,7-8,13-15H,2,6,9-11H2,1H3
- InChI Key
- DOFCLOLKFGSRTG-UHFFFAOYSA-N
- Formula
- C14H21NO
- SMILES
- CCNC(Cc1ccccc1)C1CCCO1
- Molecular Weight1
- 219.32
- CAS
- 3563-92-6
- Other Names
-
- D-threo-«alpha»-Benzyl-N-ethyltetrahydrofurfurylamine
- Zylofuramine
- 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° | 216.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -119.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.85 | kJ/mol | Joback Calculated Property |
| log10WS | -3.18 | Crippen Calculated Property | |
| logPoct/wat | 2.386 | Crippen Calculated Property | |
| McVol | 189.350 | ml/mol | McGowan Calculated Property |
| Pc | 2405.28 | kPa | Joback Calculated Property |
| Inp | [1665.00; 1665.00] |
|
|
| Inp | 1665.00 | NIST | |
| Inp | 1665.00 | NIST | |
| Tboil | 638.36 | K | Joback Calculated Property |
| Tc | 862.82 | K | Joback Calculated Property |
| Tfus | 349.09 | K | Joback Calculated Property |
| Vc | 0.703 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [522.80; 621.71] | J/mol×K | [638.36; 862.82] |
|
| Cp,gas | 522.80 | J/mol×K | 638.36 | Joback Calculated Property |
| Cp,gas | 542.45 | J/mol×K | 675.77 | Joback Calculated Property |
| Cp,gas | 560.73 | J/mol×K | 713.18 | Joback Calculated Property |
| Cp,gas | 577.74 | J/mol×K | 750.59 | Joback Calculated Property |
| Cp,gas | 593.52 | J/mol×K | 788.00 | Joback Calculated Property |
| Cp,gas | 608.15 | J/mol×K | 825.41 | Joback Calculated Property |
| Cp,gas | 621.71 | J/mol×K | 862.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Furfurylamine, «alpha»-benzyl-N-ethyl-tetrahydro-, D-threo-.
Sources
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