- InChI
- InChI=1S/C22H23NO3/c1-21(2)19(22(21,3)4)20(24)26-18(14-23)15-9-8-12-17(13-15)25-16-10-6-5-7-11-16/h5-13,18-19H,1-4H3
- InChI Key
- XQUXKZZNEFRCAW-UHFFFAOYSA-N
- Formula
- C22H23NO3
- SMILES
-
CC1(C)C(C(=O)OC(C#N)c2cccc(Oc3
ccccc3)c2)C1(C)C - Molecular Weight1
- 349.42
- CAS
- 39515-41-8
- Other Names
-
- (.+/-.)-Fenpropathrin
- 2,2,3,3-Tetramethylcyclopropanecarboxylic acid, cyano(3-phenoxyphenyl)methyl ester (fenpropathrin)
- Cyano(3-phenoxyphenyl)methyl 2,2,3,3-tetramethylcyclopropanecarboxylate
- Cyclopropanecarboxylic acid, 2,2,3,3-tetramethyl-, cyano(3-phenoxyphenyl)methyl ester
- Danimen
- Danitol
- Danitol Fiori
- Danitrol
- Fenpropanate
- Fenpropathrine
- Herald
- Kilumal
- Meiothrin
- Meothrin
- Miothrin
- Ortho danitol
- Rody
- S 3206
- SD 41706
- Smash
- Tame
- WL 41706
- XE-938
- «alpha»-Cyano-3-phenoxybenzyl 2,2,3,3-tetramethyl-1-cyclopropanecarboxylate
- «alpha»-Cyano-3-phenoxybenzyl 2,2,3,3-tetramethylcyclopropanecarboxylate
- «alpha»-Cyano-3-phenoxybenzyl 2,2,3,3-tetramethyl-1-cyclopropanecarboxylate
- «alpha»-Cyano-3-phenoxybenzyl 2,2,3,3-tetramethylcyclopropanecarboxylate
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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.
- 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° | 175.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -190.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.43 | kJ/mol | Joback Calculated Property |
| log10WS | [-6.03; -6.03] |
|
|
| log10WS | -6.03 | Aq. Sol... | |
| log10WS | -6.03 | Estimat... | |
| logPoct/wat | 5.269 | Crippen Calculated Property | |
| McVol | 277.150 | ml/mol | McGowan Calculated Property |
| Pc | 1578.46 | kPa | Joback Calculated Property |
| Inp | [2495.00; 2514.00] |
|
|
| Inp | 2514.00 | NIST | |
| Inp | 2498.00 | NIST | |
| Inp | 2495.00 | NIST | |
| Inp | 2498.00 | NIST | |
| Tboil | 959.33 | K | Joback Calculated Property |
| Tc | 1208.31 | K | Joback Calculated Property |
| Tfus | 604.70 | K | Joback Calculated Property |
| Vc | 1.065 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [902.40; 1062.91] | J/mol×K | [959.33; 1208.31] |
|
| Cp,gas | 902.40 | J/mol×K | 959.33 | Joback Calculated Property |
| Cp,gas | 925.46 | J/mol×K | 1000.83 | Joback Calculated Property |
| Cp,gas | 949.54 | J/mol×K | 1042.32 | Joback Calculated Property |
| Cp,gas | 974.99 | J/mol×K | 1083.82 | Joback Calculated Property |
| Cp,gas | 1002.14 | J/mol×K | 1125.32 | Joback Calculated Property |
| Cp,gas | 1031.33 | J/mol×K | 1166.81 | Joback Calculated Property |
| Cp,gas | 1062.91 | J/mol×K | 1208.31 | Joback Calculated Property |
| ΔfusH | 18.57 | kJ/mol | 322.50 | NIST |
Similar Compounds
Find more compounds similar to Fenpropathrin.
Sources
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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