- InChI
- InChI=1S/C16H34O/c1-4-5-6-7-8-9-10-11-12-13-14-17-15-16(2)3/h16H,4-15H2,1-3H3
- InChI Key
- BCNBKYACFICSFV-UHFFFAOYSA-N
- Formula
- C16H34O
- SMILES
- CCCCCCCCCCCCOCC(C)C
- Molecular Weight1
- 242.45
- 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 | 0.7561 | Relay (1.0) Calculated Property | |
| ΔfG° | -23.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -505.91 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.05 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.45 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.580 | Crippen Calculated Property | |
| McVol | 242.170 | ml/mol | McGowan Calculated Property |
| Pc | 1309.90 | kPa | Joback Calculated Property |
| Inp | [1627.00; 1627.00] |
|
|
| Inp | 1627.00 | NIST | |
| Inp | 1627.00 | NIST | |
| Tboil | 546.35 | K | Relay (1.0) Calculated Property |
| Tc | 718.43 | K | Relay (1.0) Calculated Property |
| Tfus | 243.79 | K | Relay (1.0) Calculated Property |
| Vc | 0.945 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [644.01; 748.35] | J/mol×K | [587.66; 749.25] |
|
| Cp,gas | 644.01 | J/mol×K | 587.66 | Joback Calculated Property |
| Cp,gas | 663.20 | J/mol×K | 614.59 | Joback Calculated Property |
| Cp,gas | 681.65 | J/mol×K | 641.52 | Joback Calculated Property |
| Cp,gas | 699.38 | J/mol×K | 668.45 | Joback Calculated Property |
| Cp,gas | 716.39 | J/mol×K | 695.38 | Joback Calculated Property |
| Cp,gas | 732.71 | J/mol×K | 722.32 | Joback Calculated Property |
| Cp,gas | 748.35 | J/mol×K | 749.25 | Joback Calculated Property |
| η | [0.0001127; 0.0048619] | Pa×s | [277.31; 587.66] |
|
| η | 0.0048619 | Pa×s | 277.31 | Joback Calculated Property |
| η | 0.0015853 | Pa×s | 329.04 | Joback Calculated Property |
| η | 0.0007009 | Pa×s | 380.76 | Joback Calculated Property |
| η | 0.0003767 | Pa×s | 432.49 | Joback Calculated Property |
| η | 0.0002311 | Pa×s | 484.21 | Joback Calculated Property |
| η | 0.0001559 | Pa×s | 535.94 | Joback Calculated Property |
| η | 0.0001127 | Pa×s | 587.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dodecyl isobutyl ether.
Sources
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