- InChI
- InChI=1S/C25H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-22-23-25(26)27-24/h24H,2-23H2,1H3
- InChI Key
- FLVQHDPEFVLJND-UHFFFAOYSA-N
- Formula
- C25H48O2
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCC1CCC(=O)
O1 - Molecular Weight1
- 380.65
- CAS
- 625835-46-3
- 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 | 1.0941 | Relay (1.0) Calculated Property | |
| ΔfG° | -12.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -814.40 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 61.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 135.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.17 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.514 | Crippen Calculated Property | |
| McVol | 359.690 | ml/mol | McGowan Calculated Property |
| Pc | 858.98 | kPa | Joback Calculated Property |
| Inp | [3060.20; 3060.20] |
|
|
| Inp | 3060.20 | NIST | |
| Inp | 3060.20 | NIST | |
| Tboil | 678.32 | K | Relay (1.0) Calculated Property |
| Tc | 867.30 | K | Relay (1.0) Calculated Property |
| Tfus | 326.65 | K | Relay (1.0) Calculated Property |
| Vc | 1.402 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1238.34; 1350.42] | J/mol×K | [881.45; 1079.67] |
|
| Cp,gas | 1238.34 | J/mol×K | 881.45 | Joback Calculated Property |
| Cp,gas | 1260.40 | J/mol×K | 914.49 | Joback Calculated Property |
| Cp,gas | 1281.04 | J/mol×K | 947.52 | Joback Calculated Property |
| Cp,gas | 1300.32 | J/mol×K | 980.56 | Joback Calculated Property |
| Cp,gas | 1318.28 | J/mol×K | 1013.60 | Joback Calculated Property |
| Cp,gas | 1334.97 | J/mol×K | 1046.63 | Joback Calculated Property |
| Cp,gas | 1350.42 | J/mol×K | 1079.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Henicosyldihydrofuran-2(3H)-one.
Sources
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