- InChI
- InChI=1S/C11H15NO/c1-9-11(13-8-7-12-9)10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3
- InChI Key
- OOBHFESNSZDWIU-UHFFFAOYSA-N
- Formula
- C11H15NO
- SMILES
- CC1NCCOC1c1ccccc1
- Molecular Weight1
- 177.24
- CAS
- 134-49-6
- Other Names
-
- Morpholine, 3-methyl-2-phenyl-
- A 66
- Oxazimedrine
- Phenmetrazin
- Probese-P
- Psychamine A 66
- 2-Phenyl-3-methylmorpholine
- 3-Methyl-2-phenylmorpholine
- 3-Methyl-2-phenyltetrahydro-2H-1,4-oxazine
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion 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.
- I : 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 | 0.3822 | Relay (1.0) Calculated Property | |
| ΔfG° | 172.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -47.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.39 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.48 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.56 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.736 | Crippen Calculated Property | |
| McVol | 147.080 | ml/mol | McGowan Calculated Property |
| Pc | 3246.73 | kPa | Joback Calculated Property |
| Inp | [1416.00; 1469.00] |
|
|
| Inp | 1416.00 | NIST | |
| Inp | 1425.00 | NIST | |
| Inp | 1458.00 | NIST | |
| Inp | 1468.00 | NIST | |
| Inp | 1468.00 | NIST | |
| Inp | 1440.00 | NIST | |
| Inp | 1468.00 | NIST | |
| Inp | 1440.00 | NIST | |
| Inp | 1430.00 | NIST | |
| Inp | 1469.00 | NIST | |
| Inp | 1419.00 | NIST | |
| Inp | 1419.00 | NIST | |
| Inp | 1420.00 | NIST | |
| Inp | 1431.00 | NIST | |
| Inp | 1425.00 | NIST | |
| Inp | 1425.00 | NIST | |
| Inp | 1420.00 | NIST | |
| Inp | 1420.00 | NIST | |
| Inp | 1431.00 | NIST | |
| I | [2089.00; 2168.00] |
|
|
| I | 2089.00 | NIST | |
| I | 2150.00 | NIST | |
| I | 2158.00 | NIST | |
| I | 2168.00 | NIST | |
| Tboil | 530.95 | K | Relay (1.0) Calculated Property |
| Tc | 757.53 | K | Relay (1.0) Calculated Property |
| Tfus | 350.70 | K | Relay (1.0) Calculated Property |
| Vc | 0.520 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [365.44; 464.68] | J/mol×K | [568.14; 814.94] |
|
| Cp,gas | 365.44 | J/mol×K | 568.14 | Joback Calculated Property |
| Cp,gas | 385.26 | J/mol×K | 609.27 | Joback Calculated Property |
| Cp,gas | 403.72 | J/mol×K | 650.41 | Joback Calculated Property |
| Cp,gas | 420.85 | J/mol×K | 691.54 | Joback Calculated Property |
| Cp,gas | 436.70 | J/mol×K | 732.67 | Joback Calculated Property |
| Cp,gas | 451.30 | J/mol×K | 773.80 | Joback Calculated Property |
| Cp,gas | 464.68 | J/mol×K | 814.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenmetrazine.
Sources
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