- InChI
- InChI=1S/C9H15ClO/c1-3-4-5-6-9(7-11)8(2)10/h7H,3-6H2,1-2H3/b9-8-
- InChI Key
- GDAAPLNTHYJTIL-HJWRWDBZSA-N
- Formula
- C9H15ClO
- SMILES
- CCCCCC(C=O)=C(C)Cl
- Molecular Weight1
- 174.67
- 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° | -23.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -232.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.85 | kJ/mol | Joback Calculated Property |
| log10WS | -3.37 | Crippen Calculated Property | |
| logPoct/wat | 3.278 | Crippen Calculated Property | |
| McVol | 147.180 | ml/mol | McGowan Calculated Property |
| Pc | 2543.05 | kPa | Joback Calculated Property |
| Inp | 1130.10 | NIST | |
| I | [1537.60; 1537.60] |
|
|
| I | 1537.60 | NIST | |
| I | 1537.60 | NIST | |
| Tboil | 495.33 | K | Joback Calculated Property |
| Tc | 685.47 | K | Joback Calculated Property |
| Tfus | 230.11 | K | Joback Calculated Property |
| Vc | 0.588 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [310.82; 377.73] | J/mol×K | [495.33; 685.47] |
|
| Cp,gas | 310.82 | J/mol×K | 495.33 | Joback Calculated Property |
| Cp,gas | 323.50 | J/mol×K | 527.02 | Joback Calculated Property |
| Cp,gas | 335.53 | J/mol×K | 558.71 | Joback Calculated Property |
| Cp,gas | 346.94 | J/mol×K | 590.40 | Joback Calculated Property |
| Cp,gas | 357.76 | J/mol×K | 622.09 | Joback Calculated Property |
| Cp,gas | 368.01 | J/mol×K | 653.78 | Joback Calculated Property |
| Cp,gas | 377.73 | J/mol×K | 685.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to E-2-(1-Chloro-ethylidene)-heptanal.
Sources
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