- InChI
- InChI=1S/C12H21NO3/c1-3-4-5-8-16-11(14)9-13(2)12(15)10-6-7-10/h10H,3-9H2,1-2H3
- InChI Key
- GLNAXEIENUMHCR-UHFFFAOYSA-N
- Formula
- C12H21NO3
- SMILES
- CCCCCOC(=O)CN(C)C(=O)C1CC1
- Molecular Weight1
- 227.30
- 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 | 0.6983 | Relay (1.0) Calculated Property | |
| ΔfG° | -141.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -615.08 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.97 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.60 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.80 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.588 | Crippen Calculated Property | |
| McVol | 188.070 | ml/mol | McGowan Calculated Property |
| Pc | 2197.95 | kPa | Joback Calculated Property |
| Inp | 1748.00 | NIST | |
| Tboil | 554.09 | K | Relay (1.0) Calculated Property |
| Tc | 754.36 | K | Relay (1.0) Calculated Property |
| Tfus | 286.42 | K | Relay (1.0) Calculated Property |
| Vc | 0.720 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [512.52; 594.06] | J/mol×K | [623.30; 810.19] | 
|
| Cp,gas | 512.52 | J/mol×K | 623.30 | Joback Calculated Property |
| Cp,gas | 528.08 | J/mol×K | 654.45 | Joback Calculated Property |
| Cp,gas | 542.80 | J/mol×K | 685.60 | Joback Calculated Property |
| Cp,gas | 556.72 | J/mol×K | 716.74 | Joback Calculated Property |
| Cp,gas | 569.89 | J/mol×K | 747.89 | Joback Calculated Property |
| Cp,gas | 582.32 | J/mol×K | 779.04 | Joback Calculated Property |
| Cp,gas | 594.06 | J/mol×K | 810.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-cyclopropylcarbonyl-, pentyl ester.
Sources
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