- InChI
- InChI=1S/C6H13NO/c1-5-3-8-4-6(2)7-5/h5-7H,3-4H2,1-2H3
- InChI Key
- MDKHWJFKHDRFFZ-UHFFFAOYSA-N
- Formula
- C6H13NO
- SMILES
- CC1COCC(C)N1
- Molecular Weight1
- 115.17
- CAS
- 123-57-9
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 17.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -227.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.34 | kJ/mol | Joback Calculated Property |
| log10WS | -0.73 | Crippen Calculated Property | |
| logPoct/wat | 0.383 | Crippen Calculated Property | |
| McVol | 100.390 | ml/mol | McGowan Calculated Property |
| Pc | 3877.12 | kPa | Joback Calculated Property |
| Tboil | 427.06 | K | Joback Calculated Property |
| Tc | 640.31 | K | Joback Calculated Property |
| Tfus | 292.12 | K | Joback Calculated Property |
| Vc | 0.361 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [204.63; 286.14] | J/mol×K | [427.06; 640.31] | 
|
| Cp,gas | 204.63 | J/mol×K | 427.06 | Joback Calculated Property |
| Cp,gas | 219.82 | J/mol×K | 462.60 | Joback Calculated Property |
| Cp,gas | 234.36 | J/mol×K | 498.14 | Joback Calculated Property |
| Cp,gas | 248.27 | J/mol×K | 533.68 | Joback Calculated Property |
| Cp,gas | 261.53 | J/mol×K | 569.23 | Joback Calculated Property |
| Cp,gas | 274.16 | J/mol×K | 604.77 | Joback Calculated Property |
| Cp,gas | 286.14 | J/mol×K | 640.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Morpholine, 3,5-dimethyl-.
Sources
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