- InChI
- InChI=1S/C14H19NO4/c1-4-8-19-13(16)10-15(2)14(17)11-6-5-7-12(9-11)18-3/h5-7,9H,4,8,10H2,1-3H3
- InChI Key
- PRMBWZPRHZWKCJ-UHFFFAOYSA-N
- Formula
- C14H19NO4
- SMILES
-
CCCOC(=O)CN(C)C(=O)c1cccc(OC)c
1 - Molecular Weight1
- 265.31
- 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 | 0.7672 | Relay (1.0) Calculated Property | |
| ΔfG° | -187.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -602.30 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.53 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.62 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.720 | Crippen Calculated Property | |
| McVol | 209.220 | ml/mol | McGowan Calculated Property |
| Pc | 2151.31 | kPa | Joback Calculated Property |
| Inp | [2128.00; 2128.00] |
|
|
| Inp | 2128.00 | NIST | |
| Inp | 2128.00 | NIST | |
| Tboil | 618.97 | K | Relay (1.0) Calculated Property |
| Tc | 807.57 | K | Relay (1.0) Calculated Property |
| Tfus | 310.30 | K | Relay (1.0) Calculated Property |
| Vc | 0.771 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [579.34; 652.92] | J/mol×K | [716.40; 920.18] |
|
| Cp,gas | 579.34 | J/mol×K | 716.40 | Joback Calculated Property |
| Cp,gas | 593.90 | J/mol×K | 750.36 | Joback Calculated Property |
| Cp,gas | 607.52 | J/mol×K | 784.33 | Joback Calculated Property |
| Cp,gas | 620.22 | J/mol×K | 818.29 | Joback Calculated Property |
| Cp,gas | 632.01 | J/mol×K | 852.25 | Joback Calculated Property |
| Cp,gas | 642.91 | J/mol×K | 886.21 | Joback Calculated Property |
| Cp,gas | 652.92 | J/mol×K | 920.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(3-methoxybenzoyl)-, propyl ester.
Sources
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