- InChI
- InChI=1S/C18H21NO3/c1-3-4-12-22-17(20)13-19(2)18(21)16-11-7-9-14-8-5-6-10-15(14)16/h5-11H,3-4,12-13H2,1-2H3
- InChI Key
- TULXTVNLKGEGLJ-UHFFFAOYSA-N
- Formula
- C18H21NO3
- SMILES
-
CCCCOC(=O)CN(C)C(=O)c1cccc2ccc
cc12 - Molecular Weight1
- 299.36
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 58.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -288.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.19 | kJ/mol | Joback Calculated Property |
| log10WS | -4.38 | Crippen Calculated Property | |
| logPoct/wat | 3.255 | Crippen Calculated Property | |
| McVol | 240.250 | ml/mol | McGowan Calculated Property |
| Pc | 1927.05 | kPa | Joback Calculated Property |
| Inp | 2522.00 | NIST | |
| Tboil | 804.48 | K | Joback Calculated Property |
| Tc | 1020.46 | K | Joback Calculated Property |
| Tfus | 518.82 | K | Joback Calculated Property |
| Vc | 0.905 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [702.53; 775.87] | J/mol×K | [804.48; 1020.46] | 
|
| Cp,gas | 702.53 | J/mol×K | 804.48 | Joback Calculated Property |
| Cp,gas | 717.06 | J/mol×K | 840.48 | Joback Calculated Property |
| Cp,gas | 730.58 | J/mol×K | 876.47 | Joback Calculated Property |
| Cp,gas | 743.14 | J/mol×K | 912.47 | Joback Calculated Property |
| Cp,gas | 754.84 | J/mol×K | 948.47 | Joback Calculated Property |
| Cp,gas | 765.72 | J/mol×K | 984.47 | Joback Calculated Property |
| Cp,gas | 775.87 | J/mol×K | 1020.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(1-naphthoyl)-, butyl ester.
Sources
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