- InChI
- InChI=1S/C30H52/c1-8-10-21-13-18-27(4)22(21)14-19-29(6)24(27)11-12-25-28(5)17-9-16-26(2,3)23(28)15-20-30(25,29)7/h21-25H,8-20H2,1-7H3/t21-,22?,23?,24?,25?,27-,28?,29?,30?/m1/s1
- InChI Key
- HRIQCHSYFFRYPR-IPONBDEGSA-N
- Formula
- C30H52
- SMILES
-
CCCC1CCC2(C)C1CCC1(C)C2CCC2C3(
C)CCCC(C)(C)C3CCC21C - Molecular Weight1
- 412.73
- 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° | 366.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -360.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.67 | kJ/mol | Joback Calculated Property |
| log10WS | -9.44 | Crippen Calculated Property | |
| logPoct/wat | 9.278 | Crippen Calculated Property | |
| McVol | 379.260 | ml/mol | McGowan Calculated Property |
| Pc | 953.78 | kPa | Joback Calculated Property |
| Inp | 3164.00 | NIST | |
| Tboil | 922.97 | K | Joback Calculated Property |
| Tc | 1163.76 | K | Joback Calculated Property |
| Tfus | 594.74 | K | Joback Calculated Property |
| Vc | 1.438 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1454.08; 1797.50] | J/mol×K | [922.97; 1163.76] | 
|
| Cp,gas | 1454.08 | J/mol×K | 922.97 | Joback Calculated Property |
| Cp,gas | 1500.69 | J/mol×K | 963.10 | Joback Calculated Property |
| Cp,gas | 1550.52 | J/mol×K | 1003.23 | Joback Calculated Property |
| Cp,gas | 1604.33 | J/mol×K | 1043.37 | Joback Calculated Property |
| Cp,gas | 1662.91 | J/mol×K | 1083.50 | Joback Calculated Property |
| Cp,gas | 1727.04 | J/mol×K | 1123.63 | Joback Calculated Property |
| Cp,gas | 1797.50 | J/mol×K | 1163.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to C30 17B,21A-Hopane (Moretane).
Sources
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