- InChI
- InChI=1S/C12H27PS3/c1-4-7-10-14-13(15-11-8-5-2)16-12-9-6-3/h4-12H2,1-3H3
- InChI Key
- KLAPGAOQRZTCBI-UHFFFAOYSA-N
- Formula
- C12H27PS3
- SMILES
- CCCCSP(SCCCC)SCCCC
- Molecular Weight1
- 298.51
- CAS
- 150-50-5
- Other Names
-
- Merphos
- Phosphorotrithious acid, tributyl ester
- Butyl phosphorotrithioite ((BuS)3P)
- Tributyl trithiophosphite
- Chemagro B-1776
- Deleaf defoliant
- Easy off-D
- Folex
- Phosphorotrithious acid, S,S,S-tributyl ester
- S,S,S-Tributyl phosphorotrithioite
- S,S,S-Tributyl trithiophosphite
- Tributylthiofosfin
- NSC 27720
- Tris(butylthio)phosphine
- S,S',S'-tributyl phosphorotrithioite
- 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 | 0.5435 | Relay (1.0) Calculated Property | |
| ΔfG° | 121.67 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -179.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 77.03 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.813 | Crippen Calculated Property | |
| McVol | 249.450 | ml/mol | McGowan Calculated Property |
| Pc | 1741.35 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 610.31 | K | Relay (1.0) Calculated Property |
| Tc | 774.86 | K | Relay (1.0) Calculated Property |
| Tfus | 243.71 | K | Relay (1.0) Calculated Property |
| Vc | 0.887 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Tributyl phosphorotrithioite.
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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