- InChI
- InChI=1S/C17H33NO3/c1-4-6-8-9-10-12-14-21-17(20)15-18(3)16(19)13-11-7-5-2/h4-15H2,1-3H3
- InChI Key
- ZXWZUZMQURKFNG-UHFFFAOYSA-N
- Formula
- C17H33NO3
- SMILES
- CCCCCCCCOC(=O)CN(C)C(=O)CCCCC
- Molecular Weight1
- 299.45
- 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° | -159.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -684.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.38 | kJ/mol | Joback Calculated Property |
| log10WS | -4.15 | Crippen Calculated Property | |
| logPoct/wat | 3.929 | Crippen Calculated Property | |
| McVol | 269.380 | ml/mol | McGowan Calculated Property |
| Pc | 1329.07 | kPa | Joback Calculated Property |
| Inp | 2197.00 | NIST | |
| Tboil | 730.96 | K | Joback Calculated Property |
| Tc | 906.84 | K | Joback Calculated Property |
| Tfus | 435.91 | K | Joback Calculated Property |
| Vc | 1.036 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [802.22; 893.82] | J/mol×K | [730.96; 906.84] | 
|
| Cp,gas | 802.22 | J/mol×K | 730.96 | Joback Calculated Property |
| Cp,gas | 819.60 | J/mol×K | 760.27 | Joback Calculated Property |
| Cp,gas | 836.10 | J/mol×K | 789.59 | Joback Calculated Property |
| Cp,gas | 851.75 | J/mol×K | 818.90 | Joback Calculated Property |
| Cp,gas | 866.57 | J/mol×K | 848.21 | Joback Calculated Property |
| Cp,gas | 880.59 | J/mol×K | 877.53 | Joback Calculated Property |
| Cp,gas | 893.82 | J/mol×K | 906.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, n-hexanoyl-, octyl ester.
Sources
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