- InChI
- InChI=1S/C30H60O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31/h30H,2-29H2,1H3
- InChI Key
- CGNVIRPGBUXJES-UHFFFAOYSA-N
- Formula
- C30H60O
- SMILES
-
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
=O - Molecular Weight1
- 436.80
- CAS
- 22725-63-9
- 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).
- 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° | 102.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -748.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 75.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.09 | kJ/mol | Joback Calculated Property |
| log10WS | -11.66 | Crippen Calculated Property | |
| logPoct/wat | 11.128 | Crippen Calculated Property | |
| McVol | 435.130 | ml/mol | McGowan Calculated Property |
| Pc | 617.57 | kPa | Joback Calculated Property |
| Inp | [3251.20; 3251.20] |
|
|
| Inp | 3251.20 | NIST | |
| Inp | 3251.20 | NIST | |
| Tboil | 934.46 | K | Joback Calculated Property |
| Tc | 1157.85 | K | Joback Calculated Property |
| Tfus | 469.86 | K | Joback Calculated Property |
| Vc | 1.732 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1512.23; 1648.70] | J/mol×K | [934.46; 1157.85] |
|
| Cp,gas | 1512.23 | J/mol×K | 934.46 | Joback Calculated Property |
| Cp,gas | 1538.77 | J/mol×K | 971.69 | Joback Calculated Property |
| Cp,gas | 1563.66 | J/mol×K | 1008.92 | Joback Calculated Property |
| Cp,gas | 1586.98 | J/mol×K | 1046.16 | Joback Calculated Property |
| Cp,gas | 1608.86 | J/mol×K | 1083.39 | Joback Calculated Property |
| Cp,gas | 1629.40 | J/mol×K | 1120.62 | Joback Calculated Property |
| Cp,gas | 1648.70 | J/mol×K | 1157.85 | Joback Calculated Property |
| η | [0.0000258; 0.0008728] | Pa×s | [469.86; 934.46] |
|
| η | 0.0008728 | Pa×s | 469.86 | Joback Calculated Property |
| η | 0.0003204 | Pa×s | 547.29 | Joback Calculated Property |
| η | 0.0001508 | Pa×s | 624.73 | Joback Calculated Property |
| η | 0.0000838 | Pa×s | 702.16 | Joback Calculated Property |
| η | 0.0000523 | Pa×s | 779.59 | Joback Calculated Property |
| η | 0.0000356 | Pa×s | 857.03 | Joback Calculated Property |
| η | 0.0000258 | Pa×s | 934.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Triacontanal.
Sources
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