- InChI
- InChI=1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-22-23/h22H,2-21H2,1H3
- InChI Key
- ZMGJNJFHZNMVCW-UHFFFAOYSA-N
- Formula
- C22H44O2
- SMILES
- CCCCCCCCCCCCCCCCCCCCCOC=O
- Molecular Weight1
- 340.58
- CAS
- 77899-03-7
- 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).
- 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 | 1.0625 | Relay (1.0) Calculated Property | |
| ΔfG° | -123.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -766.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 58.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 120.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.10 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.591 | Crippen Calculated Property | |
| McVol | 328.280 | ml/mol | McGowan Calculated Property |
| Pc | 911.08 | kPa | Joback Calculated Property |
| Tboil | 613.11 | K | Relay (1.0) Calculated Property |
| Tc | 798.55 | K | Relay (1.0) Calculated Property |
| Tfus | 320.45 | K | Relay (1.0) Calculated Property |
| Vc | 1.296 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1006.18; 1112.61] | J/mol×K | [760.48; 933.08] | 
|
| Cp,gas | 1006.18 | J/mol×K | 760.48 | Joback Calculated Property |
| Cp,gas | 1026.13 | J/mol×K | 789.25 | Joback Calculated Property |
| Cp,gas | 1045.15 | J/mol×K | 818.01 | Joback Calculated Property |
| Cp,gas | 1063.26 | J/mol×K | 846.78 | Joback Calculated Property |
| Cp,gas | 1080.51 | J/mol×K | 875.55 | Joback Calculated Property |
| Cp,gas | 1096.95 | J/mol×K | 904.32 | Joback Calculated Property |
| Cp,gas | 1112.61 | J/mol×K | 933.08 | Joback Calculated Property |
| η | [0.0001248; 0.0020502] | Pa×s | [396.40; 760.48] |
|
| η | 0.0020502 | Pa×s | 396.40 | Joback Calculated Property |
| η | 0.0009434 | Pa×s | 457.08 | Joback Calculated Property |
| η | 0.0005208 | Pa×s | 517.76 | Joback Calculated Property |
| η | 0.0003256 | Pa×s | 578.44 | Joback Calculated Property |
| η | 0.0002226 | Pa×s | 639.12 | Joback Calculated Property |
| η | 0.0001625 | Pa×s | 699.80 | Joback Calculated Property |
| η | 0.0001248 | Pa×s | 760.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Heneicosyl formate.
Sources
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