- InChI
- InChI=1S/C11H16O/c1-3-9(4-2)10-5-7-11(12)8-6-10/h5-9,12H,3-4H2,1-2H3
- InChI Key
- NXNCTLHHTLIVRD-UHFFFAOYSA-N
- Formula
- C11H16O
- SMILES
- CCC(CC)c1ccc(O)cc1
- Molecular Weight1
- 164.24
- CAS
- 29528-33-4
- 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 | 0.5792 | Relay (1.0) Calculated Property | |
| ΔfG° | -2.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -207.63 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.11 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.92 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.296 | Crippen Calculated Property | |
| McVol | 147.960 | ml/mol | McGowan Calculated Property |
| Pc | 3135.00 | kPa | Joback Calculated Property |
| Tboil | 536.41 | K | Relay (1.0) Calculated Property |
| Tc | 749.15 | K | Relay (1.0) Calculated Property |
| Tfus | 370.18 | K | Relay (1.0) Calculated Property |
| Vc | 0.497 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [357.97; 434.70] | J/mol×K | [557.94; 777.32] | 
|
| Cp,gas | 357.97 | J/mol×K | 557.94 | Joback Calculated Property |
| Cp,gas | 372.96 | J/mol×K | 594.50 | Joback Calculated Property |
| Cp,gas | 386.96 | J/mol×K | 631.07 | Joback Calculated Property |
| Cp,gas | 400.05 | J/mol×K | 667.63 | Joback Calculated Property |
| Cp,gas | 412.32 | J/mol×K | 704.20 | Joback Calculated Property |
| Cp,gas | 423.84 | J/mol×K | 740.76 | Joback Calculated Property |
| Cp,gas | 434.70 | J/mol×K | 777.32 | Joback Calculated Property |
| η | [0.0000452; 0.0046044] | Pa×s | [336.87; 557.94] |
|
| η | 0.0046044 | Pa×s | 336.87 | Joback Calculated Property |
| η | 0.0014575 | Pa×s | 373.72 | Joback Calculated Property |
| η | 0.0005672 | Pa×s | 410.56 | Joback Calculated Property |
| η | 0.0002578 | Pa×s | 447.41 | Joback Calculated Property |
| η | 0.0001322 | Pa×s | 484.25 | Joback Calculated Property |
| η | 0.0000744 | Pa×s | 521.10 | Joback Calculated Property |
| η | 0.0000452 | Pa×s | 557.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-(3-Pentyl)phenol.
Sources
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