- InChI
- InChI=1S/C23H37NO3/c1-4-6-8-9-10-11-12-18-27-22(25)19-24(3)23(26)21-16-14-20(15-17-21)13-7-5-2/h14-17H,4-13,18-19H2,1-3H3
- InChI Key
- PEDWOAOLWNZFBR-UHFFFAOYSA-N
- Formula
- C23H37NO3
- SMILES
-
CCCCCCCCCOC(=O)CN(C)C(=O)c1ccc
(CCCC)cc1 - Molecular Weight1
- 375.54
- ω : Acentric Factor.
- 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).
- 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 | 1.0590 | Relay (1.0) Calculated Property | |
| ΔfG° | -6.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -687.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.54 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.395 | Crippen Calculated Property | |
| McVol | 330.160 | ml/mol | McGowan Calculated Property |
| Pc | 1108.89 | kPa | Joback Calculated Property |
| Inp | 2948.00 | NIST | |
| Tboil | 672.49 | K | Relay (1.0) Calculated Property |
| Tc | 875.15 | K | Relay (1.0) Calculated Property |
| Tfus | 296.49 | K | Relay (1.0) Calculated Property |
| Vc | 1.239 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1071.26; 1158.47] | J/mol×K | [899.90; 1104.15] | 
|
| Cp,gas | 1071.26 | J/mol×K | 899.90 | Joback Calculated Property |
| Cp,gas | 1088.62 | J/mol×K | 933.94 | Joback Calculated Property |
| Cp,gas | 1104.77 | J/mol×K | 967.98 | Joback Calculated Property |
| Cp,gas | 1119.78 | J/mol×K | 1002.02 | Joback Calculated Property |
| Cp,gas | 1133.70 | J/mol×K | 1036.07 | Joback Calculated Property |
| Cp,gas | 1146.58 | J/mol×K | 1070.11 | Joback Calculated Property |
| Cp,gas | 1158.47 | J/mol×K | 1104.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(4-butylbenzoyl)-, nonyl ester.
Sources
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