- InChI
- InChI=1S/C16H30O2/c1-3-5-7-8-9-10-11-12-14-16(17)18-15-13-6-4-2/h3H,1,4-15H2,2H3
- InChI Key
- UODPTRHAWGAWQL-UHFFFAOYSA-N
- Formula
- C16H30O2
- SMILES
- C=CCCCCCCCCC(=O)OCCCCC
- Molecular Weight1
- 254.41
- CAS
- 18451-96-2
- Other Names
-
- 10-Undecenoic acid, pentyl ester
- pentyl undec-10-enoate
- 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 | 0.7887 | Relay (1.0) Calculated Property | |
| ΔfG° | -138.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -587.70 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 40.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.36 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.05 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.027 | Crippen Calculated Property | |
| McVol | 239.440 | ml/mol | McGowan Calculated Property |
| Pc | 1364.66 | kPa | Joback Calculated Property |
| Inp | 1760.00 | NIST | |
| I | 2053.00 | NIST | |
| Tboil | 574.11 | K | Relay (1.0) Calculated Property |
| Tc | 744.77 | K | Relay (1.0) Calculated Property |
| Tfus | 254.39 | K | Relay (1.0) Calculated Property |
| Vc | 0.904 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [644.91; 739.38] | J/mol×K | [620.58; 787.39] | 
|
| Cp,gas | 644.91 | J/mol×K | 620.58 | Joback Calculated Property |
| Cp,gas | 662.54 | J/mol×K | 648.38 | Joback Calculated Property |
| Cp,gas | 679.39 | J/mol×K | 676.18 | Joback Calculated Property |
| Cp,gas | 695.49 | J/mol×K | 703.99 | Joback Calculated Property |
| Cp,gas | 710.84 | J/mol×K | 731.79 | Joback Calculated Property |
| Cp,gas | 725.46 | J/mol×K | 759.59 | Joback Calculated Property |
| Cp,gas | 739.38 | J/mol×K | 787.39 | Joback Calculated Property |
| η | [0.0001155; 0.0036129] | Pa×s | [310.65; 620.58] |
|
| η | 0.0036129 | Pa×s | 310.65 | Joback Calculated Property |
| η | 0.0013521 | Pa×s | 362.30 | Joback Calculated Property |
| η | 0.0006467 | Pa×s | 413.96 | Joback Calculated Property |
| η | 0.0003643 | Pa×s | 465.61 | Joback Calculated Property |
| η | 0.0002301 | Pa×s | 517.27 | Joback Calculated Property |
| η | 0.0001580 | Pa×s | 568.92 | Joback Calculated Property |
| η | 0.0001155 | Pa×s | 620.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentyl 10-undecenoate.
Sources
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