- InChI
- InChI=1S/C19H29NO3/c1-4-5-6-7-8-9-13-23-18(21)15-20(3)19(22)17-12-10-11-16(2)14-17/h10-12,14H,4-9,13,15H2,1-3H3
- InChI Key
- LGGFBNPFBRLSEK-UHFFFAOYSA-N
- Formula
- C19H29NO3
- SMILES
-
CCCCCCCCOC(=O)CN(C)C(=O)c1cccc
(C)c1 - Molecular Weight1
- 319.44
- 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° | -40.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -500.28 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.77 | kJ/mol | Joback Calculated Property |
| log10WS | -4.72 | Crippen Calculated Property | |
| logPoct/wat | 3.971 | Crippen Calculated Property | |
| McVol | 273.800 | ml/mol | McGowan Calculated Property |
| Pc | 1457.90 | kPa | Joback Calculated Property |
| Inp | 2479.00 | NIST | |
| Tboil | 808.38 | K | Joback Calculated Property |
| Tc | 1006.82 | K | Joback Calculated Property |
| Tfus | 497.39 | K | Joback Calculated Property |
| Vc | 1.040 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [831.73; 914.85] | J/mol×K | [808.38; 1006.82] | 
|
| Cp,gas | 831.73 | J/mol×K | 808.38 | Joback Calculated Property |
| Cp,gas | 848.10 | J/mol×K | 841.45 | Joback Calculated Property |
| Cp,gas | 863.41 | J/mol×K | 874.53 | Joback Calculated Property |
| Cp,gas | 877.70 | J/mol×K | 907.60 | Joback Calculated Property |
| Cp,gas | 891.01 | J/mol×K | 940.67 | Joback Calculated Property |
| Cp,gas | 903.38 | J/mol×K | 973.74 | Joback Calculated Property |
| Cp,gas | 914.85 | J/mol×K | 1006.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(3-methylbenzoyl)-, octyl ester.
Sources
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