- InChI
- InChI=1S/C23H28N2O3/c1-3-5-7-9-23(27)28-21-16-14-20(15-17-21)25-24-19-12-10-18(11-13-19)22(26)8-6-4-2/h10-17H,3-9H2,1-2H3/b25-24+
- InChI Key
- NDZAITBGXOSPTF-OCOZRVBESA-N
- Formula
- C23H28N2O3
- SMILES
-
CCCCCC(=O)Oc1ccc(N=Nc2ccc(C(=O
)CCCC)cc2)cc1 - Molecular Weight1
- 380.48
- CAS
- 120102-99-0
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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).
- 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 |
|---|---|---|---|
| ω | 1.0980 | Relay (1.0) Calculated Property | |
| ΔfG° | 25.10 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -321.06 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 115.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.961 | Crippen Calculated Property | |
| McVol | 312.080 | ml/mol | McGowan Calculated Property |
| Pc | 1151.44 | kPa | Joback Calculated Property |
| Tboil | 702.72 | K | Relay (1.0) Calculated Property |
| Tc | 951.35 | K | Relay (1.0) Calculated Property |
| Tfus | 370.58 | K | Relay (1.0) Calculated Property |
| Vc | 1.144 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 4-n-Pentanoyl-4-n'-hexanoyloxyazobenzene.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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