- InChI
- InChI=1S/C14H25NO3/c1-11(2)7-6-8-18-14(17)10-15(5)13(16)9-12(3)4/h9,11H,6-8,10H2,1-5H3
- InChI Key
- SVVZZOAXBYMKJW-UHFFFAOYSA-N
- Formula
- C14H25NO3
- SMILES
-
CC(C)=CC(=O)N(C)CC(=O)OCCCC(C)
C - Molecular Weight1
- 255.35
- 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 | 0.7135 | Relay (1.0) Calculated Property | |
| ΔfG° | -115.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -661.28 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.62 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.49 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.390 | Crippen Calculated Property | |
| McVol | 222.810 | ml/mol | McGowan Calculated Property |
| Pc | 1750.67 | kPa | Joback Calculated Property |
| Inp | 1856.00 | NIST | |
| Tboil | 561.56 | K | Relay (1.0) Calculated Property |
| Tc | 750.04 | K | Relay (1.0) Calculated Property |
| Tfus | 289.07 | K | Relay (1.0) Calculated Property |
| Vc | 0.815 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [611.61; 696.18] | J/mol×K | [665.92; 851.21] | 
|
| Cp,gas | 611.61 | J/mol×K | 665.92 | Joback Calculated Property |
| Cp,gas | 627.70 | J/mol×K | 696.80 | Joback Calculated Property |
| Cp,gas | 642.95 | J/mol×K | 727.68 | Joback Calculated Property |
| Cp,gas | 657.39 | J/mol×K | 758.56 | Joback Calculated Property |
| Cp,gas | 671.06 | J/mol×K | 789.45 | Joback Calculated Property |
| Cp,gas | 683.98 | J/mol×K | 820.33 | Joback Calculated Property |
| Cp,gas | 696.18 | J/mol×K | 851.21 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(3-methylbut-2-enoyl)-, isohexyl ester.
Sources
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