- InChI
- InChI=1S/C30H39O4P/c1-7-22(4)25-10-16-28(17-11-25)32-35(31,33-29-18-12-26(13-19-29)23(5)8-2)34-30-20-14-27(15-21-30)24(6)9-3/h10-24H,7-9H2,1-6H3
- InChI Key
- CVQJIHIPOBDGET-UHFFFAOYSA-N
- Formula
- C30H39O4P
- SMILES
-
CCC(C)c1ccc(OP(=O)(Oc2ccc(C(C)
CC)cc2)Oc2ccc(C(C)CC)cc2)cc1 - Molecular Weight1
- 494.60
- CAS
- 116402-16-5
- 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 | 1.0573 | Relay (1.0) Calculated Property | |
| ΔfG° | -60.82 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -725.32 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 133.32 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.21 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.99 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.872 | Crippen Calculated Property | |
| McVol | 406.220 | ml/mol | McGowan Calculated Property |
| Pc | 546.72 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 747.18 | K | Relay (1.0) Calculated Property |
| Tc | 1035.58 | K | Relay (1.0) Calculated Property |
| Tfus | 351.60 | K | Relay (1.0) Calculated Property |
| Vc | 1.478 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
![Ethanol, 2-[4-(1-methylpropyl)phenoxy]-.](data:image/png;base64,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)
Find more compounds similar to P-sec-butyl phenyl phosphate.
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
- McGowan Method
- NIST Webbook
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