- InChI
- InChI=1S/C32H56/c1-8-9-11-22(2)23-15-19-30(5)26(23)17-21-32(7)28(30)14-13-27-24-12-10-18-29(3,4)25(24)16-20-31(27,32)6/h22-28H,8-21H2,1-7H3/t22-,23+,24?,25?,26+,27?,28?,30-,31+,32+/m1/s1
- InChI Key
- XCRHOWRYNNGKCR-DCDBGDEKSA-N
- Formula
- C32H56
- SMILES
-
CCCCC(C)C1CCC2(C)C1CCC1(C)C2CC
C2C3CCCC(C)(C)C3CCC21C - Molecular Weight1
- 440.79
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 386.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -422.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.89 | kJ/mol | Joback Calculated Property |
| log10WS | -10.03 | Crippen Calculated Property | |
| logPoct/wat | 9.914 | Crippen Calculated Property | |
| McVol | 407.440 | ml/mol | McGowan Calculated Property |
| Pc | 831.94 | kPa | Joback Calculated Property |
| Inp | [3301.00; 3301.00] |
|
|
| Inp | 3301.00 | NIST | |
| Inp | 3301.00 | NIST | |
| Tboil | 968.05 | K | Joback Calculated Property |
| Tc | 1203.22 | K | Joback Calculated Property |
| Tfus | 578.38 | K | Joback Calculated Property |
| Vc | 1.546 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1605.16; 1935.08] | J/mol×K | [968.05; 1203.22] |
|
| Cp,gas | 1605.16 | J/mol×K | 968.05 | Joback Calculated Property |
| Cp,gas | 1651.50 | J/mol×K | 1007.24 | Joback Calculated Property |
| Cp,gas | 1700.46 | J/mol×K | 1046.44 | Joback Calculated Property |
| Cp,gas | 1752.67 | J/mol×K | 1085.63 | Joback Calculated Property |
| Cp,gas | 1808.76 | J/mol×K | 1124.83 | Joback Calculated Property |
| Cp,gas | 1869.35 | J/mol×K | 1164.02 | Joback Calculated Property |
| Cp,gas | 1935.08 | J/mol×K | 1203.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to C33-25-Norhopane, 17aH, 21bH, 22S.
Sources
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