- InChI
- InChI=1S/C21H39NO3/c1-3-4-5-6-7-8-9-10-11-14-17-25-20(23)18-22(2)21(24)19-15-12-13-16-19/h19H,3-18H2,1-2H3
- InChI Key
- HGXJPHCNNPQWHV-UHFFFAOYSA-N
- Formula
- C21H39NO3
- SMILES
-
CCCCCCCCCCCCOC(=O)CN(C)C(=O)C1
CCCC1 - Molecular Weight1
- 353.54
- 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 | 0.9679 | Relay (1.0) Calculated Property | |
| ΔfG° | -89.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -824.42 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 51.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.58 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.099 | Crippen Calculated Property | |
| McVol | 314.880 | ml/mol | McGowan Calculated Property |
| Pc | 1151.44 | kPa | Joback Calculated Property |
| Inp | 2672.00 | NIST | |
| Tboil | 637.14 | K | Relay (1.0) Calculated Property |
| Tc | 850.82 | K | Relay (1.0) Calculated Property |
| Tfus | 316.44 | K | Relay (1.0) Calculated Property |
| Vc | 1.187 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1035.00; 1133.91] | J/mol×K | [837.76; 1031.09] | 
|
| Cp,gas | 1035.00 | J/mol×K | 837.76 | Joback Calculated Property |
| Cp,gas | 1054.32 | J/mol×K | 869.98 | Joback Calculated Property |
| Cp,gas | 1072.44 | J/mol×K | 902.20 | Joback Calculated Property |
| Cp,gas | 1089.41 | J/mol×K | 934.42 | Joback Calculated Property |
| Cp,gas | 1105.28 | J/mol×K | 966.64 | Joback Calculated Property |
| Cp,gas | 1120.10 | J/mol×K | 998.86 | Joback Calculated Property |
| Cp,gas | 1133.91 | J/mol×K | 1031.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(cyclopentylcarbonyl)-, dodecyl ester.
Sources
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