- InChI
- InChI=1S/C11H22ClN/c1-4-6-8-13(9-7-5-2)11(3)10-12/h10H,4-9H2,1-3H3/b11-10+
- InChI Key
- ZZIWHDLPHPYLFH-ZHACJKMWSA-N
- Formula
- C11H22ClN
- SMILES
- CCCCN(CCCC)C(C)=CCl
- Molecular Weight1
- 203.75
- 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 | 0.5317 | Relay (1.0) Calculated Property | |
| ΔfG° | 212.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -158.96 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.61 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 6.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.78 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.989 | Crippen Calculated Property | |
| McVol | 183.770 | ml/mol | McGowan Calculated Property |
| Pc | 1964.82 | kPa | Joback Calculated Property |
| Inp | [1362.80; 1362.80] |
|
|
| Inp | 1362.80 | NIST | |
| Inp | 1362.80 | NIST | |
| I | [1487.40; 1487.40] |
|
|
| I | 1487.40 | NIST | |
| I | 1487.40 | NIST | |
| Tboil | 508.45 | K | Relay (1.0) Calculated Property |
| Tc | 688.44 | K | Relay (1.0) Calculated Property |
| Tfus | 241.64 | K | Relay (1.0) Calculated Property |
| Vc | 0.657 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [412.25; 498.05] | J/mol×K | [504.99; 681.23] |
|
| Cp,gas | 412.25 | J/mol×K | 504.99 | Joback Calculated Property |
| Cp,gas | 428.38 | J/mol×K | 534.36 | Joback Calculated Property |
| Cp,gas | 443.73 | J/mol×K | 563.74 | Joback Calculated Property |
| Cp,gas | 458.34 | J/mol×K | 593.11 | Joback Calculated Property |
| Cp,gas | 472.24 | J/mol×K | 622.48 | Joback Calculated Property |
| Cp,gas | 485.47 | J/mol×K | 651.86 | Joback Calculated Property |
| Cp,gas | 498.05 | J/mol×K | 681.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to E-(3-chloro-2-methyl-allyl)-dibutyl-amine.
Sources
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