- InChI
- InChI=1S/C15H28O2/c1-4-5-6-7-8-9-10-11-12-17-15(16)13-14(2)3/h13H,4-12H2,1-3H3
- InChI Key
- CCXPZXOKHQNDHA-UHFFFAOYSA-N
- Formula
- C15H28O2
- SMILES
- CCCCCCCCCCOC(=O)C=C(C)C
- Molecular Weight1
- 240.38
- CAS
- 56500-46-0
- Other Names
-
- Decyl senecioate
- 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 | 0.7553 | Relay (1.0) Calculated Property | |
| ΔfG° | -86.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -577.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.03 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.00 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.42 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.636 | Crippen Calculated Property | |
| McVol | 225.350 | ml/mol | McGowan Calculated Property |
| Pc | 1531.86 | kPa | Joback Calculated Property |
| Inp | [1719.40; 1719.40] |
|
|
| Inp | 1719.40 | NIST | |
| Inp | 1719.40 | NIST | |
| Tboil | 552.70 | K | Relay (1.0) Calculated Property |
| Tc | 735.89 | K | Relay (1.0) Calculated Property |
| Tfus | 266.45 | K | Relay (1.0) Calculated Property |
| Vc | 0.855 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [600.32; 692.52] | J/mol×K | [622.93; 798.18] |
|
| Cp,gas | 600.32 | J/mol×K | 622.93 | Joback Calculated Property |
| Cp,gas | 617.53 | J/mol×K | 652.14 | Joback Calculated Property |
| Cp,gas | 633.97 | J/mol×K | 681.35 | Joback Calculated Property |
| Cp,gas | 649.67 | J/mol×K | 710.55 | Joback Calculated Property |
| Cp,gas | 664.64 | J/mol×K | 739.76 | Joback Calculated Property |
| Cp,gas | 678.92 | J/mol×K | 768.97 | Joback Calculated Property |
| Cp,gas | 692.52 | J/mol×K | 798.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methyl-2-butenoic acid, decyl ester.
Sources
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