- InChI
- InChI=1S/C10H12ClNO/c11-9-4-2-8(3-5-9)10-12-6-1-7-13-10/h2-5,10,12H,1,6-7H2
- InChI Key
- IUSGGJOQPVRUFH-UHFFFAOYSA-N
- Formula
- C10H12ClNO
- SMILES
- Clc1ccc(C2NCCCO2)cc1
- Molecular Weight1
- 197.66
- CAS
- 109086-75-1
- 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° | 150.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -80.28 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.87 | kJ/mol | Joback Calculated Property |
| log10WS | -2.92 | Crippen Calculated Property | |
| logPoct/wat | 2.348 | Crippen Calculated Property | |
| McVol | 145.230 | ml/mol | McGowan Calculated Property |
| Pc | 3551.53 | kPa | Joback Calculated Property |
| Tboil | 592.34 | K | Joback Calculated Property |
| Tc | 849.40 | K | Joback Calculated Property |
| Tfus | 410.30 | K | Joback Calculated Property |
| Vc | 0.527 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [343.72; 427.35] | J/mol×K | [592.34; 849.40] | 
|
| Cp,gas | 343.72 | J/mol×K | 592.34 | Joback Calculated Property |
| Cp,gas | 360.72 | J/mol×K | 635.18 | Joback Calculated Property |
| Cp,gas | 376.44 | J/mol×K | 678.03 | Joback Calculated Property |
| Cp,gas | 390.93 | J/mol×K | 720.87 | Joback Calculated Property |
| Cp,gas | 404.21 | J/mol×K | 763.71 | Joback Calculated Property |
| Cp,gas | 416.34 | J/mol×K | 806.55 | Joback Calculated Property |
| Cp,gas | 427.35 | J/mol×K | 849.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2H-1,3-Oxazine, 2-(4-chlorophenyl)tetrahydro-.
Sources
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