- InChI
- InChI=1S/C17H28/c1-3-5-8-12-16(13-9-6-4-2)17-14-10-7-11-15-17/h7,10-11,14-16H,3-6,8-9,12-13H2,1-2H3
- InChI Key
- WCABIRIFXVXGQH-UHFFFAOYSA-N
- Formula
- C17H28
- SMILES
- CCCCCC(CCCCC)c1ccccc1
- Molecular Weight1
- 232.40
- CAS
- 4537-14-8
- Other Names
-
- Undecane, 6-phenyl-
- 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.
- I : 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 | 0.6210 | Relay (1.0) Calculated Property | |
| ΔfG° | 202.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -139.35 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.65 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.931 | Crippen Calculated Property | |
| McVol | 226.630 | ml/mol | McGowan Calculated Property |
| Pc | 1586.01 | kPa | Joback Calculated Property |
| Inp | [278.10; 1625.00] |
|
|
| Inp | 1625.00 | NIST | |
| Inp | 1625.00 | NIST | |
| Inp | 1620.00 | NIST | |
| Inp | 278.10 | NIST | |
| Inp | 1620.00 | NIST | |
| Inp | 278.10 | NIST | |
| I | [1820.00; 1820.00] |
|
|
| I | 1820.00 | NIST | |
| I | 1820.00 | NIST | |
| Tboil | 561.19 | K | Relay (1.0) Calculated Property |
| Tc | 756.33 | K | Relay (1.0) Calculated Property |
| Tfus | 244.77 | K | Relay (1.0) Calculated Property |
| Vc | 0.842 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [598.89; 703.04] | J/mol×K | [614.80; 805.49] |
|
| Cp,gas | 598.89 | J/mol×K | 614.80 | Joback Calculated Property |
| Cp,gas | 618.71 | J/mol×K | 646.58 | Joback Calculated Property |
| Cp,gas | 637.50 | J/mol×K | 678.36 | Joback Calculated Property |
| Cp,gas | 655.28 | J/mol×K | 710.15 | Joback Calculated Property |
| Cp,gas | 672.11 | J/mol×K | 741.93 | Joback Calculated Property |
| Cp,gas | 688.01 | J/mol×K | 773.71 | Joback Calculated Property |
| Cp,gas | 703.04 | J/mol×K | 805.49 | Joback Calculated Property |
| η | [0.0001272; 0.0044125] | Pa×s | [292.77; 614.80] |
|
| η | 0.0044125 | Pa×s | 292.77 | Joback Calculated Property |
| η | 0.0015456 | Pa×s | 346.44 | Joback Calculated Property |
| η | 0.0007174 | Pa×s | 400.11 | Joback Calculated Property |
| η | 0.0003993 | Pa×s | 453.78 | Joback Calculated Property |
| η | 0.0002515 | Pa×s | 507.46 | Joback Calculated Property |
| η | 0.0001731 | Pa×s | 561.13 | Joback Calculated Property |
| η | 0.0001272 | Pa×s | 614.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, (1-pentylhexyl)-.
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