- InChI
- InChI=1S/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H2/t3-/m0/s1
- InChI Key
- BRLQWZUYTZBJKN-VKHMYHEASA-N
- Formula
- C3H5ClO
- SMILES
- ClCC1CO1
- Molecular Weight1
- 92.52
- CAS
- 67843-74-7
- Other Names
-
- Oxirane, 2-(chloromethyl)-, (2S)-
- (S)-Epichlorohydrin
- (2S)-chloromethyl-oxirane
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -117.96 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.84 | kJ/mol | Joback Calculated Property |
| IE | 10.54 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 0.624 | Crippen Calculated Property | |
| McVol | 60.380 | ml/mol | McGowan Calculated Property |
| Tboil | 389.99 | K | Relay (1.0) Calculated Property |
| Tfus | 217.40 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [93.28; 130.88] | J/mol×K | [339.16; 530.37] | 
|
| Cp,gas | 93.28 | J/mol×K | 339.16 | Joback Calculated Property |
| Cp,gas | 100.62 | J/mol×K | 371.03 | Joback Calculated Property |
| Cp,gas | 107.50 | J/mol×K | 402.90 | Joback Calculated Property |
| Cp,gas | 113.95 | J/mol×K | 434.76 | Joback Calculated Property |
| Cp,gas | 119.98 | J/mol×K | 466.63 | Joback Calculated Property |
| Cp,gas | 125.61 | J/mol×K | 498.50 | Joback Calculated Property |
| Cp,gas | 130.88 | J/mol×K | 530.37 | Joback Calculated Property |
| η | [0.0004154; 0.0011282] | Pa×s | [198.00; 339.16] |
|
| η | 0.0011282 | Pa×s | 198.00 | Joback Calculated Property |
| η | 0.0008743 | Pa×s | 221.53 | Joback Calculated Property |
| η | 0.0007115 | Pa×s | 245.05 | Joback Calculated Property |
| η | 0.0006004 | Pa×s | 268.58 | Joback Calculated Property |
| η | 0.0005206 | Pa×s | 292.11 | Joback Calculated Property |
| η | 0.0004612 | Pa×s | 315.63 | Joback Calculated Property |
| η | 0.0004154 | Pa×s | 339.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (S)-(+)-Epichlorohydrin.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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