- InChI
- InChI=1S/C29H44/c1-19-12-15-26(4)17-18-28(6)23(25(26)21(19)3)10-11-24-27(5)14-8-9-20(2)22(27)13-16-29(24,28)7/h9-11,19,21-22,25H,8,12-18H2,1-7H3
- InChI Key
- QSFCELCDWHMMTE-UHFFFAOYSA-N
- Formula
- C29H44
- SMILES
-
CC1=CCCC2(C)C3=CC=C4C5C(C)C(C)
CCC5(C)CCC4(C)C3(C)CCC12 - Molecular Weight1
- 392.66
- CAS
- 930591-91-6
- 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° | 428.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -182.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.25 | kJ/mol | Joback Calculated Property |
| log10WS | -9.06 | Crippen Calculated Property | |
| logPoct/wat | 8.504 | Crippen Calculated Property | |
| McVol | 352.270 | ml/mol | McGowan Calculated Property |
| Pc | 1087.06 | kPa | Joback Calculated Property |
| Inp | 3042.70 | NIST | |
| Tboil | 925.88 | K | Joback Calculated Property |
| Tc | 1175.47 | K | Joback Calculated Property |
| Tfus | 604.37 | K | Joback Calculated Property |
| Vc | 1.335 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1297.55; 1599.97] | J/mol×K | [925.88; 1175.47] | 
|
| Cp,gas | 1297.55 | J/mol×K | 925.88 | Joback Calculated Property |
| Cp,gas | 1338.79 | J/mol×K | 967.48 | Joback Calculated Property |
| Cp,gas | 1382.74 | J/mol×K | 1009.08 | Joback Calculated Property |
| Cp,gas | 1430.11 | J/mol×K | 1050.68 | Joback Calculated Property |
| Cp,gas | 1481.63 | J/mol×K | 1092.27 | Joback Calculated Property |
| Cp,gas | 1538.01 | J/mol×K | 1133.87 | Joback Calculated Property |
| Cp,gas | 1599.97 | J/mol×K | 1175.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 24-Norursa-3,9(11),12-triene.
Sources
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