- InChI
- InChI=1S/C20H26/c1-5-13-6-2-11-17-18-12-4-8-14-7-3-10-16(20(14)18)15(9-1)19(13)17/h13-14H,1-12H2
- InChI Key
- JAEIWHRMTMZKDG-UHFFFAOYSA-N
- Formula
- C20H26
- SMILES
-
C1Cc2c3c4c(c5c2C(C1)CCC5)CCCC4
CCC3 - Molecular Weight1
- 266.42
- CAS
- 7594-86-7
- Other Names
-
- 1,2,3,3a,4,5,6,7,8,9,9a,10,11,12-Tetradecahydroperylene
- 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).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 416.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 42.61 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.31 | kJ/mol | Joback Calculated Property |
| log10WS | -6.63 | Crippen Calculated Property | |
| logPoct/wat | 5.199 | Crippen Calculated Property | |
| McVol | 225.460 | ml/mol | McGowan Calculated Property |
| Pc | 1982.35 | kPa | Joback Calculated Property |
| Tboil | 753.42 | K | Joback Calculated Property |
| Tc | 1000.36 | K | Joback Calculated Property |
| Tfus | 477.38 | K | Joback Calculated Property |
| Vc | 0.862 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [711.57; 826.76] | J/mol×K | [753.42; 1000.36] | 
|
| Cp,gas | 711.57 | J/mol×K | 753.42 | Joback Calculated Property |
| Cp,gas | 733.56 | J/mol×K | 794.58 | Joback Calculated Property |
| Cp,gas | 754.14 | J/mol×K | 835.73 | Joback Calculated Property |
| Cp,gas | 773.54 | J/mol×K | 876.89 | Joback Calculated Property |
| Cp,gas | 791.96 | J/mol×K | 918.04 | Joback Calculated Property |
| Cp,gas | 809.62 | J/mol×K | 959.20 | Joback Calculated Property |
| Cp,gas | 826.76 | J/mol×K | 1000.36 | Joback Calculated Property |
| η | [0.0022031; 0.0041641] | Pa×s | [477.38; 753.42] |
|
| η | 0.0041641 | Pa×s | 477.38 | Joback Calculated Property |
| η | 0.0035743 | Pa×s | 523.39 | Joback Calculated Property |
| η | 0.0031447 | Pa×s | 569.39 | Joback Calculated Property |
| η | 0.0028202 | Pa×s | 615.40 | Joback Calculated Property |
| η | 0.0025678 | Pa×s | 661.41 | Joback Calculated Property |
| η | 0.0023666 | Pa×s | 707.41 | Joback Calculated Property |
| η | 0.0022031 | Pa×s | 753.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Perylene, 1,2,3,3a,4,5,6,7,8,9,9a,10,11,12-tetradecahydro-.
Sources
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