- InChI
- InChI=1S/C2H8NO4P/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6)
- InChI Key
- SUHOOTKUPISOBE-UHFFFAOYSA-N
- Formula
- C2H8NO4P
- SMILES
- NCCOP(=O)(O)O
- Molecular Weight1
- 141.06
- CAS
- 1071-23-4
- Other Names
-
- 2-Aminoethyl dihydrogen phosphate
- O-Phosphocolamine
- O-Phosphoethanolamine
- Colaminphosphoric acid
- O-Phosphorylethanolamine
- Ethanol, 2-amino-, dihydrogen phosphate
- Colamine phosphate
- Ethanol, 2-amino-, dihydrogen phosphate (ester)
- Ethanol, 2-amino-, phosphate
- Ethanolamine phosphate
- Ethanolamine O-phosphate
- Mono(2-aminoethyl) phosphate
- Pe 104
- Phosphoethanolamine
- Phosphonoethanolamine
- Phosphoryethanolamine
- Ethanol, 2-amino-, 1-(dihydrogen phosphate)
- NSC 254167
- 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 | 0.8726 | Relay (1.0) Calculated Property | |
| ΔfG° | -494.50 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -768.76 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 87.45 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.51 | eV | Relay (1.0) Calculated Property |
| log10WS | 2.02 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.946 | Crippen Calculated Property | |
| McVol | 92.960 | ml/mol | McGowan Calculated Property |
| Pc | 4134.30 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 522.28 | K | Relay (1.0) Calculated Property |
| Tc | 755.15 | K | Relay (1.0) Calculated Property |
| Tfus | 321.44 | K | Relay (1.0) Calculated Property |
| Vc | 0.353 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Phosphorylethanolamine.
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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