- InChI
- InChI=1S/C11H17Cl/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-7H2
- InChI Key
- VZUOFLCVOCPUCM-UHFFFAOYSA-N
- Formula
- C11H17Cl
- SMILES
- ClCC12CC3CC(CC(C3)C1)C2
- Molecular Weight1
- 184.71
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 186.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -78.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.92 | kJ/mol | Joback Calculated Property |
| log10WS | -3.30 | Crippen Calculated Property | |
| logPoct/wat | 3.442 | Crippen Calculated Property | |
| McVol | 145.510 | ml/mol | McGowan Calculated Property |
| Pc | 2817.33 | kPa | Joback Calculated Property |
| Inp | [1404.00; 1455.00] |
|
|
| Inp | 1409.00 | NIST | |
| Inp | 1409.00 | NIST | |
| Inp | 1404.00 | NIST | |
| Inp | 1423.00 | NIST | |
| Inp | 1440.00 | NIST | |
| Inp | 1455.00 | NIST | |
| Inp | 1409.00 | NIST | |
| Inp | 1455.00 | NIST | |
| I | [1791.00; 1844.00] |
|
|
| I | 1800.00 | NIST | |
| I | 1800.00 | NIST | |
| I | 1791.00 | NIST | |
| I | 1818.00 | NIST | |
| I | 1844.00 | NIST | |
| Tboil | 508.57 | K | Joback Calculated Property |
| Tc | 734.19 | K | Joback Calculated Property |
| Tfus | 313.61 | K | Joback Calculated Property |
| Vc | 0.560 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [354.54; 455.81] | J/mol×K | [508.57; 734.19] |
|
| Cp,gas | 354.54 | J/mol×K | 508.57 | Joback Calculated Property |
| Cp,gas | 374.91 | J/mol×K | 546.17 | Joback Calculated Property |
| Cp,gas | 393.60 | J/mol×K | 583.78 | Joback Calculated Property |
| Cp,gas | 410.83 | J/mol×K | 621.38 | Joback Calculated Property |
| Cp,gas | 426.79 | J/mol×K | 658.99 | Joback Calculated Property |
| Cp,gas | 441.72 | J/mol×K | 696.59 | Joback Calculated Property |
| Cp,gas | 455.81 | J/mol×K | 734.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-chloromethyladamantane.
Sources
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