- InChI
- InChI=1S/C25H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25(26)27-24-4-2/h4H,2-3,5-24H2,1H3
- InChI Key
- VNVRAKHWAVVIGF-UHFFFAOYSA-N
- Formula
- C25H48O2
- SMILES
-
C=CCOC(=O)CCCCCCCCCCCCCCCCCCCC
C - Molecular Weight1
- 380.65
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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 | 1.1069 | Relay (1.0) Calculated Property | |
| ΔfG° | 13.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -768.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 62.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.46 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.89 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.28 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.537 | Crippen Calculated Property | |
| McVol | 366.250 | ml/mol | McGowan Calculated Property |
| Pc | 802.51 | kPa | Joback Calculated Property |
| Inp | [2654.00; 2654.00] |
|
|
| Inp | 2654.00 | NIST | |
| Inp | 2654.00 | NIST | |
| Tboil | 647.68 | K | Relay (1.0) Calculated Property |
| Tc | 817.14 | K | Relay (1.0) Calculated Property |
| Tfus | 305.96 | K | Relay (1.0) Calculated Property |
| Vc | 1.406 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1192.62; 1305.41] | J/mol×K | [844.37; 1033.82] |
|
| Cp,gas | 1192.62 | J/mol×K | 844.37 | Joback Calculated Property |
| Cp,gas | 1214.26 | J/mol×K | 875.94 | Joback Calculated Property |
| Cp,gas | 1234.69 | J/mol×K | 907.52 | Joback Calculated Property |
| Cp,gas | 1253.98 | J/mol×K | 939.09 | Joback Calculated Property |
| Cp,gas | 1272.17 | J/mol×K | 970.67 | Joback Calculated Property |
| Cp,gas | 1289.29 | J/mol×K | 1002.24 | Joback Calculated Property |
| Cp,gas | 1305.41 | J/mol×K | 1033.82 | Joback Calculated Property |
| η | [0.0000387; 0.0009493] | Pa×s | [441.91; 844.37] |
|
| η | 0.0009493 | Pa×s | 441.91 | Joback Calculated Property |
| η | 0.0003918 | Pa×s | 508.99 | Joback Calculated Property |
| η | 0.0001987 | Pa×s | 576.06 | Joback Calculated Property |
| η | 0.0001161 | Pa×s | 643.14 | Joback Calculated Property |
| η | 0.0000751 | Pa×s | 710.22 | Joback Calculated Property |
| η | 0.0000524 | Pa×s | 777.29 | Joback Calculated Property |
| η | 0.0000387 | Pa×s | 844.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Allyl behenoate.
Sources
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