- InChI
- InChI=1S/C9H14/c1-2-3-6-9-7-4-5-8-9/h4-5,7H,2-3,6,8H2,1H3
- InChI Key
- FTFYDDRPCCMKBT-UHFFFAOYSA-N
- Formula
- C9H14
- SMILES
- CCCCC1=CC=CC1
- Molecular Weight1
- 122.21
- 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 | 0.2897 | Relay (... Calculated Property | |
| ΔfG° | 119.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 25.85 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 13.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.43 | kJ/mol | Relay (... Calculated Property |
| IE | 8.37 | eV | Relay (... Calculated Property |
| log10WS | -3.67 | Relay (... Calculated Property | |
| logPoct/wat | 3.063 | Crippen Calculated Property | |
| McVol | 118.210 | ml/mol | McGowan Calculated Property |
| Pc | 3045.68 | kPa | Joback Calculated Property |
| Inp | [916.00; 916.00] |
|
|
| Inp | 916.00 | NIST | |
| Inp | 916.00 | NIST | |
| I | 1118.10 | NIST | |
| Tboil | 421.89 | K | Relay (... Calculated Property |
| Tc | 609.89 | K | Relay (... Calculated Property |
| Tfus | 187.97 | K | Relay (... Calculated Property |
| Vc | 0.441 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [229.94; 305.43] | J/mol×K | [428.57; 625.48] |
|
| Cp,gas | 229.94 | J/mol×K | 428.57 | Joback Calculated Property |
| Cp,gas | 244.32 | J/mol×K | 461.39 | Joback Calculated Property |
| Cp,gas | 257.93 | J/mol×K | 494.21 | Joback Calculated Property |
| Cp,gas | 270.82 | J/mol×K | 527.03 | Joback Calculated Property |
| Cp,gas | 283.01 | J/mol×K | 559.85 | Joback Calculated Property |
| Cp,gas | 294.54 | J/mol×K | 592.66 | Joback Calculated Property |
| Cp,gas | 305.43 | J/mol×K | 625.48 | Joback Calculated Property |
| η | [0.0002749; 0.0029321] | Pa×s | [220.37; 428.57] |
|
| η | 0.0029321 | Pa×s | 220.37 | Joback Calculated Property |
| η | 0.0015112 | Pa×s | 255.07 | Joback Calculated Property |
| η | 0.0009129 | Pa×s | 289.77 | Joback Calculated Property |
| η | 0.0006142 | Pa×s | 324.47 | Joback Calculated Property |
| η | 0.0004461 | Pa×s | 359.17 | Joback Calculated Property |
| η | 0.0003428 | Pa×s | 393.87 | Joback Calculated Property |
| η | 0.0002749 | Pa×s | 428.57 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Cyclopentadiene, 1-butyl.
Sources
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