- InChI
- InChI=1S/C27H42O5/c1-2-3-4-5-6-9-12-15-22-31-26(29)16-13-10-7-8-11-14-17-27(30)32-25-20-18-24(23-28)19-21-25/h18-21,23H,2-17,22H2,1H3
- InChI Key
- VROJYOBKNXAXPK-UHFFFAOYSA-N
- Formula
- C27H42O5
- SMILES
-
CCCCCCCCCCOC(=O)CCCCCCCCC(=O)O
c1ccc(C=O)cc1 - Molecular Weight1
- 446.62
- 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° | -288.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -950.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 67.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 103.67 | kJ/mol | Joback Calculated Property |
| log10WS | -8.42 | Crippen Calculated Property | |
| logPoct/wat | 7.209 | Crippen Calculated Property | |
| McVol | 383.980 | ml/mol | McGowan Calculated Property |
| Pc | 902.89 | kPa | Joback Calculated Property |
| Inp | [3534.00; 3534.00] |
|
|
| Inp | 3534.00 | NIST | |
| Inp | 3534.00 | NIST | |
| Tboil | 1050.06 | K | Joback Calculated Property |
| Tc | 1291.61 | K | Joback Calculated Property |
| Tfus | 619.31 | K | Joback Calculated Property |
| Vc | 1.504 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1319.07; 1389.90] | J/mol×K | [1050.06; 1291.61] |
|
| Cp,gas | 1319.07 | J/mol×K | 1050.06 | Joback Calculated Property |
| Cp,gas | 1335.11 | J/mol×K | 1090.32 | Joback Calculated Property |
| Cp,gas | 1349.35 | J/mol×K | 1130.58 | Joback Calculated Property |
| Cp,gas | 1361.89 | J/mol×K | 1170.83 | Joback Calculated Property |
| Cp,gas | 1372.78 | J/mol×K | 1211.09 | Joback Calculated Property |
| Cp,gas | 1382.09 | J/mol×K | 1251.35 | Joback Calculated Property |
| Cp,gas | 1389.90 | J/mol×K | 1291.61 | Joback Calculated Property |
| η | [0.0000207; 0.0002502] | Pa×s | [619.31; 1050.06] |
|
| η | 0.0002502 | Pa×s | 619.31 | Joback Calculated Property |
| η | 0.0001331 | Pa×s | 691.10 | Joback Calculated Property |
| η | 0.0000797 | Pa×s | 762.89 | Joback Calculated Property |
| η | 0.0000521 | Pa×s | 834.68 | Joback Calculated Property |
| η | 0.0000365 | Pa×s | 906.48 | Joback Calculated Property |
| η | 0.0000269 | Pa×s | 978.27 | Joback Calculated Property |
| η | 0.0000207 | Pa×s | 1050.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, decyl 4-formylphenyl ester.
Sources
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