- InChI
- InChI=1S/C14H22O/c1-3-5-7-12-9-10-14(15)13(11-12)8-6-4-2/h9-11,15H,3-8H2,1-2H3
- InChI Key
- KPZBEZVZFBDKCG-UHFFFAOYSA-N
- Formula
- C14H22O
- SMILES
- CCCCc1ccc(O)c(CCCC)c1
- Molecular Weight1
- 206.32
- 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 | 0.7402 | Relay (1.0) Calculated Property | |
| ΔfG° | 15.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -269.42 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 31.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.76 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.00 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.51 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.077 | Crippen Calculated Property | |
| McVol | 190.230 | ml/mol | McGowan Calculated Property |
| Pc | 2274.07 | kPa | Joback Calculated Property |
| Inp | [1491.00; 1491.00] |
|
|
| Inp | 1491.00 | NIST | |
| Inp | 1491.00 | NIST | |
| Tboil | 566.74 | K | Relay (1.0) Calculated Property |
| Tc | 776.73 | K | Relay (1.0) Calculated Property |
| Tfus | 289.09 | K | Relay (1.0) Calculated Property |
| Vc | 0.701 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [505.16; 590.05] | J/mol×K | [632.20; 837.79] |
|
| Cp,gas | 505.16 | J/mol×K | 632.20 | Joback Calculated Property |
| Cp,gas | 521.31 | J/mol×K | 666.46 | Joback Calculated Property |
| Cp,gas | 536.56 | J/mol×K | 700.73 | Joback Calculated Property |
| Cp,gas | 551.00 | J/mol×K | 734.99 | Joback Calculated Property |
| Cp,gas | 564.67 | J/mol×K | 769.26 | Joback Calculated Property |
| Cp,gas | 577.67 | J/mol×K | 803.52 | Joback Calculated Property |
| Cp,gas | 590.05 | J/mol×K | 837.79 | Joback Calculated Property |
| η | [0.0000233; 0.0010778] | Pa×s | [398.20; 632.20] |
|
| η | 0.0010778 | Pa×s | 398.20 | Joback Calculated Property |
| η | 0.0004279 | Pa×s | 437.20 | Joback Calculated Property |
| η | 0.0001976 | Pa×s | 476.20 | Joback Calculated Property |
| η | 0.0001026 | Pa×s | 515.20 | Joback Calculated Property |
| η | 0.0000584 | Pa×s | 554.20 | Joback Calculated Property |
| η | 0.0000358 | Pa×s | 593.20 | Joback Calculated Property |
| η | 0.0000233 | Pa×s | 632.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dibutylphenol.
Sources
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