- InChI
- InChI=1S/C19H34/c1-14-8-6-9-16-18(14,4)13-10-15-17(2,3)11-7-12-19(15,16)5/h14-16H,6-13H2,1-5H3/t14?,15?,16?,18-,19-/m0/s1
- InChI Key
- JAQCKRGOHDLTRL-WFZCBACDSA-N
- Formula
- C19H34
- SMILES
-
CC1CCCC2C1(C)CCC1C(C)(C)CCCC12
C - Molecular Weight1
- 262.47
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.3872 | Relay (... Calculated Property | |
| ΔfG° | 191.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -256.88 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 13.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.87 | kJ/mol | Relay (... Calculated Property |
| IE | 8.64 | eV | Relay (... Calculated Property |
| log10WS | -6.50 | Relay (... Calculated Property | |
| logPoct/wat | 6.055 | Crippen Calculated Property | |
| McVol | 245.990 | ml/mol | McGowan Calculated Property |
| Pc | 1611.58 | kPa | Joback Calculated Property |
| Inp | 1915.00 | NIST | |
| Tboil | 588.65 | K | Relay (... Calculated Property |
| Tc | 829.92 | K | Relay (... Calculated Property |
| Tfus | 339.19 | K | Relay (... Calculated Property |
| Vc | 0.878 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [752.38; 915.45] | J/mol×K | [662.40; 898.99] | 
|
| Cp,gas | 752.38 | J/mol×K | 662.40 | Joback Calculated Property |
| Cp,gas | 781.24 | J/mol×K | 701.83 | Joback Calculated Property |
| Cp,gas | 808.84 | J/mol×K | 741.26 | Joback Calculated Property |
| Cp,gas | 835.64 | J/mol×K | 780.69 | Joback Calculated Property |
| Cp,gas | 862.05 | J/mol×K | 820.12 | Joback Calculated Property |
| Cp,gas | 888.51 | J/mol×K | 859.55 | Joback Calculated Property |
| Cp,gas | 915.45 | J/mol×K | 898.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Perhydrophenanthrene, 1,4bB,8,8,10aB-pentamethyl.
Sources
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