- InChI
- InChI=1S/C16H29NO3/c1-3-5-6-7-8-9-10-11-14-20-16(19)12-13-17-15(18)4-2/h4H,2-3,5-14H2,1H3,(H,17,18)
- InChI Key
- ZUNFPBSVDQJZOJ-UHFFFAOYSA-N
- Formula
- C16H29NO3
- SMILES
- C=CC(=O)NCCC(=O)OCCCCCCCCCC
- Molecular Weight1
- 283.41
- 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° | -101.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -552.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.88 | kJ/mol | Joback Calculated Property |
| log10WS | -4.20 | Crippen Calculated Property | |
| logPoct/wat | 3.363 | Crippen Calculated Property | |
| McVol | 250.990 | ml/mol | McGowan Calculated Property |
| Pc | 1490.74 | kPa | Joback Calculated Property |
| Inp | 2204.00 | NIST | |
| Tboil | 742.49 | K | Joback Calculated Property |
| Tc | 923.71 | K | Joback Calculated Property |
| Tfus | 443.07 | K | Joback Calculated Property |
| Vc | 0.978 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [739.62; 822.78] | J/mol×K | [742.49; 923.71] | 
|
| Cp,gas | 739.62 | J/mol×K | 742.49 | Joback Calculated Property |
| Cp,gas | 755.50 | J/mol×K | 772.69 | Joback Calculated Property |
| Cp,gas | 770.54 | J/mol×K | 802.90 | Joback Calculated Property |
| Cp,gas | 784.76 | J/mol×K | 833.10 | Joback Calculated Property |
| Cp,gas | 798.20 | J/mol×K | 863.31 | Joback Calculated Property |
| Cp,gas | 810.87 | J/mol×K | 893.51 | Joback Calculated Property |
| Cp,gas | 822.78 | J/mol×K | 923.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to «beta»-Alanine, N-acryloyl-, decyl ester.
Sources
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