- InChI
- InChI=1S/C9H21O3P/c1-4-6-8-11-13(3,10)12-9-7-5-2/h4-9H2,1-3H3
- InChI Key
- NPNBLTJGRBYCJB-UHFFFAOYSA-N
- Formula
- C9H21O3P
- SMILES
- CCCCOP(C)(=O)OCCCC
- Molecular Weight1
- 208.24
- CAS
- 2404-73-1
- Other Names
-
- DBMP
- Dibutyl methylphosphonate
- Phosphonic acid, methyl-, dibutyl ester
- Phosphonic acid, methyl-, O,O-dibutyl ester
- Methylphosphonic acid, dibutyl ester
- 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 | 0.6041 | Relay (1.0) Calculated Property | |
| ΔfG° | -329.91 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -745.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 72.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.00 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.87 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.443 | Crippen Calculated Property | |
| McVol | 175.740 | ml/mol | McGowan Calculated Property |
| Pc | 2161.29 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 530.84 | K | Relay (1.0) Calculated Property |
| Tc | 661.31 | K | Relay (1.0) Calculated Property |
| Tfus | 205.81 | K | Relay (1.0) Calculated Property |
| Vc | 0.684 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Dibutyl methanephosphonate.
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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