- InChI
- InChI=1S/C24H27NO4/c26-21(18-28-23-12-6-2-7-13-23)16-25(20-10-4-1-5-11-20)17-22(27)19-29-24-14-8-3-9-15-24/h1-15,21-22,26-27H,16-19H2
- InChI Key
- PGJOBAKEAXXLSG-UHFFFAOYSA-N
- Formula
- C24H27NO4
- SMILES
-
OC(COc1ccccc1)CN(CC(O)COc1cccc
c1)c1ccccc1 - Molecular Weight1
- 393.48
- CAS
- 3088-05-9
- Other Names
-
- N,N-Bis(3-phenoxy-2-hydroxypropyl)aniline
- 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).
- ΔsubH : Enthalpy of sublimation at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- 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 |
|---|---|---|---|
| ΔcH°solid | -12720.00 ± 4.20 | kJ/mol | NIST |
| ΔfG° | 110.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -436.80 ± 4.20 | kJ/mol | NIST |
| ΔfH°solid | -582.80 ± 4.20 | kJ/mol | NIST |
| ΔfusH° | 46.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.29 | kJ/mol | Joback Calculated Property |
| log10WS | -4.51 | Crippen Calculated Property | |
| logPoct/wat | 3.373 | Crippen Calculated Property | |
| McVol | 311.200 | ml/mol | McGowan Calculated Property |
| Pc | 1787.88 | kPa | Joback Calculated Property |
| Tboil | 1069.32 | K | Joback Calculated Property |
| Tc | 1309.29 | K | Joback Calculated Property |
| Tfus | 608.07 | K | Joback Calculated Property |
| Vc | 1.135 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1037.62; 1090.19] | J/mol×K | [1069.32; 1309.29] | 
|
|
T(K) Ideal gas heat capacity (J/mol×K) 1040 1050 1060 1070 1080 1090 1100 1200 1300 | ||||
| Cp,gas | 1037.62 | J/mol×K | 1069.32 | Joback Calculated Property |
| Cp,gas | 1048.75 | J/mol×K | 1109.32 | Joback Calculated Property |
| Cp,gas | 1058.78 | J/mol×K | 1149.31 | Joback Calculated Property |
| Cp,gas | 1067.82 | J/mol×K | 1189.31 | Joback Calculated Property |
| Cp,gas | 1076.00 | J/mol×K | 1229.30 | Joback Calculated Property |
| Cp,gas | 1083.41 | J/mol×K | 1269.30 | Joback Calculated Property |
| Cp,gas | 1090.19 | J/mol×K | 1309.29 | Joback Calculated Property |
| ΔsubH | 146.00 ± 4.20 | kJ/mol | 388.00 | NIST |
| ΔvapH | 131.00 | kJ/mol | 405.50 | NIST |
Similar Compounds
Find more compounds similar to Benzenamine, N,N-bis(2-hydroxy-3-phenoxypropyl)-.
Sources
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