- InChI
- InChI=1S/C13H17NO/c1-2-8-14-9-10-15-13(11-14)12-6-4-3-5-7-12/h2-7,13H,1,8-11H2
- InChI Key
- RVCFINBSQLHKPW-UHFFFAOYSA-N
- Formula
- C13H17NO
- SMILES
- C=CCN1CCOC(c2ccccc2)C1
- Molecular Weight1
- 203.28
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.3847 | Relay (1.0) Calculated Property | |
| ΔfG° | 245.45 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 48.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 76.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.246 | Crippen Calculated Property | |
| McVol | 170.960 | ml/mol | McGowan Calculated Property |
| Pc | 2436.23 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1597.14; 1603.49] |
|
|
| Inp | 1601.45 | NIST | |
| Inp | 1603.49 | NIST | |
| Inp | 1597.14 | NIST | |
| Tboil | 549.29 | K | Relay (1.0) Calculated Property |
| Tc | 768.82 | K | Relay (1.0) Calculated Property |
| Tfus | 316.41 | K | Relay (1.0) Calculated Property |
| Vc | 0.597 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-phenyl-4-allyl-tetrahydro-1,4-oxazine.
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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