- InChI
- InChI=1S/C20H33NO3S/c1-3-4-5-6-7-8-9-10-11-14-24-20(23)17-21(2)19(22)16-18-13-12-15-25-18/h12-13,15H,3-11,14,16-17H2,1-2H3
- InChI Key
- PUKWCCWALLCTRB-UHFFFAOYSA-N
- Formula
- C20H33NO3S
- SMILES
-
CCCCCCCCCCCOC(=O)CN(C)C(=O)Cc1
cccs1 - Molecular Weight1
- 367.55
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.9745 | Relay (1.0) Calculated Property | |
| ΔfG° | -69.62 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -648.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 110.18 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.41 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.59 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.823 | Crippen Calculated Property | |
| McVol | 308.540 | ml/mol | McGowan Calculated Property |
| Pc | 1297.08 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2865.00; 2865.00] |
|
|
| Inp | 2865.00 | NIST | |
| Inp | 2865.00 | NIST | |
| Tboil | 649.25 | K | Relay (1.0) Calculated Property |
| Tc | 860.26 | K | Relay (1.0) Calculated Property |
| Tfus | 317.14 | K | Relay (1.0) Calculated Property |
| Vc | 1.146 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(2-thiophenylacetyl)-, undecyl ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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