- InChI
- InChI=1S/C18H32O2/c19-18(20)16-10-8-6-4-2-1-3-5-7-9-13-17-14-11-12-15-17/h11,14,17H,1-10,12-13,15-16H2,(H,19,20)/t17-/m0/s1
- InChI Key
- XMVQWNRDPAAMJB-KRWDZBQOSA-N
- Formula
- C18H32O2
- SMILES
- O=C(O)CCCCCCCCCCCCC1C=CCC1
- Molecular Weight1
- 280.45
- CAS
- 29106-32-9
- Other Names
-
- 13-(2-cyclopenten-1-yl)tridecanoic acid
- 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 | 0.9924 | Relay (1.0) Calculated Property | |
| ΔfG° | -98.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -619.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 124.94 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.15 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.718 | Crippen Calculated Property | |
| McVol | 256.760 | ml/mol | McGowan Calculated Property |
| Pc | 1508.15 | kPa | Joback Calculated Property |
| Inp | [2230.50; 2230.50] |
|
|
| Inp | 2230.50 | NIST | |
| Inp | 2230.50 | NIST | |
| Tboil | 622.71 | K | Relay (1.0) Calculated Property |
| Tc | 829.21 | K | Relay (1.0) Calculated Property |
| Tfus | 341.30 ± 2.00 | K | NIST |
| Vc | 0.954 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [801.58; 890.25] | J/mol×K | [771.73; 955.37] |
|
| Cp,gas | 801.58 | J/mol×K | 771.73 | Joback Calculated Property |
| Cp,gas | 818.49 | J/mol×K | 802.34 | Joback Calculated Property |
| Cp,gas | 834.49 | J/mol×K | 832.94 | Joback Calculated Property |
| Cp,gas | 849.63 | J/mol×K | 863.55 | Joback Calculated Property |
| Cp,gas | 863.94 | J/mol×K | 894.16 | Joback Calculated Property |
| Cp,gas | 877.46 | J/mol×K | 924.76 | Joback Calculated Property |
| Cp,gas | 890.25 | J/mol×K | 955.37 | Joback Calculated Property |
| η | [0.0000370; 0.0025117] | Pa×s | [415.03; 771.73] |
|
| η | 0.0025117 | Pa×s | 415.03 | Joback Calculated Property |
| η | 0.0008009 | Pa×s | 474.48 | Joback Calculated Property |
| η | 0.0003294 | Pa×s | 533.93 | Joback Calculated Property |
| η | 0.0001619 | Pa×s | 593.38 | Joback Calculated Property |
| η | 0.0000905 | Pa×s | 652.83 | Joback Calculated Property |
| η | 0.0000558 | Pa×s | 712.28 | Joback Calculated Property |
| η | 0.0000370 | Pa×s | 771.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 13-(cyclopent-2-enyl)tridecanoic acid.
Sources
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