- InChI
- InChI=1S/C13H23NO3/c1-3-4-5-6-9-17-12(15)10-14(2)13(16)11-7-8-11/h11H,3-10H2,1-2H3
- InChI Key
- LOQHHSSIKMOENL-UHFFFAOYSA-N
- Formula
- C13H23NO3
- SMILES
- CCCCCCOC(=O)CN(C)C(=O)C1CC1
- Molecular Weight1
- 241.33
- 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 | 0.7354 | Relay (1.0) Calculated Property | |
| ΔfG° | -132.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -636.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.58 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.24 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.978 | Crippen Calculated Property | |
| McVol | 202.160 | ml/mol | McGowan Calculated Property |
| Pc | 2012.70 | kPa | Joback Calculated Property |
| Inp | 1851.00 | NIST | |
| Tboil | 564.47 | K | Relay (1.0) Calculated Property |
| Tc | 766.08 | K | Relay (1.0) Calculated Property |
| Tfus | 287.72 | K | Relay (1.0) Calculated Property |
| Vc | 0.776 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [565.00; 649.00] | J/mol×K | [646.18; 831.41] | 
|
| Cp,gas | 565.00 | J/mol×K | 646.18 | Joback Calculated Property |
| Cp,gas | 581.01 | J/mol×K | 677.05 | Joback Calculated Property |
| Cp,gas | 596.16 | J/mol×K | 707.92 | Joback Calculated Property |
| Cp,gas | 610.50 | J/mol×K | 738.80 | Joback Calculated Property |
| Cp,gas | 624.06 | J/mol×K | 769.67 | Joback Calculated Property |
| Cp,gas | 636.88 | J/mol×K | 800.54 | Joback Calculated Property |
| Cp,gas | 649.00 | J/mol×K | 831.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-cyclopropylcarbonyl-, hexyl ester.
Sources
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