- InChI
- InChI=1S/C28H38N2O3/c1-3-5-6-7-8-9-10-11-12-13-14-28(32)33-26-21-19-25(20-22-26)30-29-24-17-15-23(16-18-24)27(31)4-2/h15-22H,3-14H2,1-2H3/b30-29+
- InChI Key
- FFEMJSHTGJQOPX-QVIHXGFCSA-N
- Formula
- C28H38N2O3
- SMILES
-
CCCCCCCCCCCCC(=O)Oc1ccc(N=Nc2c
cc(C(=O)CC)cc2)cc1 - Molecular Weight1
- 450.61
- CAS
- 76204-59-6
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (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).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -481.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.37 | kJ/mol | Joback Calculated Property |
| log10WS | -9.51 | Crippen Calculated Property | |
| logPoct/wat | 8.911 | Crippen Calculated Property | |
| McVol | 382.530 | ml/mol | McGowan Calculated Property |
| Pc | 851.47 | kPa | Joback Calculated Property |
| Tboil | 1182.72 | K | Joback Calculated Property |
| Tc | 1450.70 | K | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔfusH | 44.77 | kJ/mol | 374.65 | NIST |
| ΔfusS | 119.50 | J/mol×K | 374.65 | NIST |
Similar Compounds
Find more compounds similar to 4-Propionyl-4'-n-tridecanoyloxyazobenzene.
Sources
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