- InChI
- InChI=1S/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3/t17-,19-/m0/s1
- InChI Key
- RLLPVAHGXHCWKJ-HKUYNNGSSA-N
- Formula
- C21H20Cl2O3
- SMILES
-
CC1(C)C(C=C(Cl)Cl)C1C(=O)OCc1c
ccc(Oc2ccccc2)c1 - Molecular Weight1
- 391.29
- CAS
- 54774-45-7
- Other Names
-
- (+)-cis-Permethrin
- (1R)-cis-Permethrin
- Permethrin cis
- cis-Permethrin
- 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).
- 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 | 0.6808 | Relay (... Calculated Property | |
| ΔfG° | 89.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -297.69 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 43.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 111.62 | kJ/mol | Relay (... Calculated Property |
| IE | 8.02 | eV | Relay (... Calculated Property |
| log10WS | -6.72 | Relay (... Calculated Property | |
| logPoct/wat | 6.113 | Crippen Calculated Property | |
| McVol | 281.860 | ml/mol | McGowan Calculated Property |
| Pc | 1644.42 | kPa | Joback Calculated Property |
| Tboil | 656.38 | K | Relay (... Calculated Property |
| Tc | 953.48 | K | Relay (... Calculated Property |
| Tfus | 323.24 | K | Relay (... Calculated Property |
| Vc | 0.956 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [837.42; 946.56] | J/mol×K | [913.47; 1160.83] | 
|
| Cp,gas | 837.42 | J/mol×K | 913.47 | Joback Calculated Property |
| Cp,gas | 855.30 | J/mol×K | 954.70 | Joback Calculated Property |
| Cp,gas | 872.99 | J/mol×K | 995.92 | Joback Calculated Property |
| Cp,gas | 890.73 | J/mol×K | 1037.15 | Joback Calculated Property |
| Cp,gas | 908.75 | J/mol×K | 1078.38 | Joback Calculated Property |
| Cp,gas | 927.28 | J/mol×K | 1119.60 | Joback Calculated Property |
| Cp,gas | 946.56 | J/mol×K | 1160.83 | Joback Calculated Property |
Similar Compounds
Sources
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