- InChI
- InChI=1S/C30H52/c1-26(2)15-8-17-29(6)22-11-13-25-28(5,20-21(22)10-12-23(26)29)19-14-24-27(3,4)16-9-18-30(24,25)7/h21-25H,8-20H2,1-7H3/t21?,22-,23-,24?,25?,28-,29+,30-/m1/s1
- InChI Key
- SKHPWXHRIDLXBT-RSNZLUEJSA-N
- Formula
- C30H52
- SMILES
-
CC1(C)CCCC2(C)C3CCC4C(C)(CCC5C
(C)(C)CCCC54C)CC3CCC12 - 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° | 342.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -373.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.02 | 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 | 983.93 | kPa | Joback Calculated Property |
| Inp | [3200.00; 3200.00] |
|
|
| Inp | 3200.00 | NIST | |
| Inp | 3200.00 | NIST | |
| Tboil | 931.51 | K | Joback Calculated Property |
| Tc | 1183.18 | K | Joback Calculated Property |
| Tfus | 587.70 | K | Joback Calculated Property |
| Vc | 1.421 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1467.83; 1832.00] | J/mol×K | [931.51; 1183.18] |
|
| Cp,gas | 1467.83 | J/mol×K | 931.51 | Joback Calculated Property |
| Cp,gas | 1517.05 | J/mol×K | 973.46 | Joback Calculated Property |
| Cp,gas | 1569.71 | J/mol×K | 1015.40 | Joback Calculated Property |
| Cp,gas | 1626.67 | J/mol×K | 1057.35 | Joback Calculated Property |
| Cp,gas | 1688.79 | J/mol×K | 1099.29 | Joback Calculated Property |
| Cp,gas | 1756.95 | J/mol×K | 1141.24 | Joback Calculated Property |
| Cp,gas | 1832.00 | J/mol×K | 1183.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to serratane-II.
Sources
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