- InChI
- InChI=1S/C27H46N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26(31)28-25(22-30)27(32)23-18-20-24(21-19-23)29(33)34/h18-21,25,27,30,32H,2-17,22H2,1H3,(H,28,31)
- InChI Key
- ULVKSVBYCYGJMG-UHFFFAOYSA-N
- Formula
- C27H46N2O5
- SMILES
-
CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(
O)c1ccc([N+](=O)[O-])cc1 - Molecular Weight1
- 478.66
- CAS
- 36136-05-7
- 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).
- 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).
- 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 | -16133.71 | kJ/mol | NIST |
| ΔfG° | -3.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -760.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 78.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 140.99 | kJ/mol | Joback Calculated Property |
| log10WS | -8.94 | Crippen Calculated Property | |
| logPoct/wat | 6.367 | Crippen Calculated Property | |
| McVol | 408.240 | ml/mol | McGowan Calculated Property |
| Pc | 972.91 | kPa | Joback Calculated Property |
| Tboil | 1288.18 | K | Joback Calculated Property |
| Tc | 1663.96 | K | Joback Calculated Property |
| Tfus | 770.83 | K | Joback Calculated Property |
| Vc | 1.589 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1521.06; 1627.56] | J/mol×K | [1288.18; 1663.96] | 
|
| Cp,gas | 1521.06 | J/mol×K | 1288.18 | Joback Calculated Property |
| Cp,gas | 1540.31 | J/mol×K | 1350.81 | Joback Calculated Property |
| Cp,gas | 1558.26 | J/mol×K | 1413.44 | Joback Calculated Property |
| Cp,gas | 1575.45 | J/mol×K | 1476.07 | Joback Calculated Property |
| Cp,gas | 1592.38 | J/mol×K | 1538.70 | Joback Calculated Property |
| Cp,gas | 1609.58 | J/mol×K | 1601.33 | Joback Calculated Property |
| Cp,gas | 1627.56 | J/mol×K | 1663.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-Stearoyldextramine.
Sources
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