- InChI
- InChI=1S/C6H13NO3/c8-4-1-2-6(10)7-3-5-9/h8-9H,1-5H2,(H,7,10)
- InChI Key
- MFHPPMMWHSHDSI-UHFFFAOYSA-N
- Formula
- C6H13NO3
- SMILES
- OCCCC(O)=NCCO
- Molecular Weight1
- 147.17
- CAS
- 66857-17-8
- 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 | 0.9159 | Relay (1.0) Calculated Property | |
| ΔfG° | -244.26 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -582.81 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 114.39 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.47 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.45 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.292 | Crippen Calculated Property | |
| McVol | 118.690 | ml/mol | McGowan Calculated Property |
| Pc | 3819.82 | kPa | Joback Calculated Property |
| Tboil | 603.79 | K | Relay (1.0) Calculated Property |
| Tc | 855.71 | K | Relay (1.0) Calculated Property |
| Tfus | 357.59 | K | Relay (1.0) Calculated Property |
| Vc | 0.427 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Butyramide, 4-hydroxy-n-(2-hydroxyethyl)-.
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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