- InChI
- InChI=1S/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H2
- InChI Key
- BRLQWZUYTZBJKN-UHFFFAOYSA-N
- Formula
- C3H5ClO
- SMILES
- ClCC1CO1
- Molecular Weight1
- 92.52
- CAS
- 13403-37-7
- Other Names
-
- Propane, 1-chloro-2,3-epoxy-
- «alpha»-Epichlorohydrin
- «gamma»-Chloropropylene oxide
- (Chloromethyl)ethylene oxide
- (Chloromethyl)oxirane
- Chloropropylene oxide
- Epichlorohydrin
- Glycerol epichlorohydrin
- Glycidyl chloride
- SKEkhG
- 1-Chloro-2,3-Epoxypropane
- 1,2-Epoxy-3-chloropropane
- 2-(Chloromethyl)oxirane
- 2,3-Epoxypropyl chloride
- 3-Chloro-1,2-epoxypropane
- 3-Chloro-1,2-propylene oxide
- 3-Chloropropene-1,2-oxide
- 3-Chloropropylene oxide
- (DL)-«alpha»-Epichlorohydrin
- Epichlorhydrin
- Epichloorhydrine
- Epichlorhydrine
- Epichlorohydryna
- Epicloridrina
- Glycerol epichlorhydrin
- Oxirane, 2-(chloromethyl)
- 1-Chloor-2,3-epoxy-propaan
- 1-Chlor-2,3-epoxy-propan
- 1-Cloro-2,3-epossipropano
- Epichlorophydrin
- Rcra waste number U041
- UN 2023
- NSC 6747
- 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.
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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 | 389.70 | K | NIST |
| Tfus | 214.00 | 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [76.45; 181.63] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.98690e+01 | |||
| Coefficient B | 4.43500e-01 | |||
| Coefficient C | -3.66100e-04 | |||
| Coefficient D | 1.24100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 76.45 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 96.71 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 113.91 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 128.44 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 140.70 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 151.08 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 159.97 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 167.76 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 174.85 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 181.63 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0011282; 0.0003677] | Pa×s | [198.00; 371.48] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -9.18752e+00 | |||
| Coefficient B | 4.75270e+02 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 198.00 | |||
| Temperature range, max. | 371.48 | |||
| η | 0.0011282 | Pa×s | 198.00 | Calculated Property |
| η | 0.0009118 | Pa×s | 217.28 | Calculated Property |
| η | 0.0007629 | Pa×s | 236.55 | Calculated Property |
| η | 0.0006558 | Pa×s | 255.83 | Calculated Property |
| η | 0.0005757 | Pa×s | 275.10 | Calculated Property |
| η | 0.0005141 | Pa×s | 294.38 | Calculated Property |
| η | 0.0004656 | Pa×s | 313.65 | Calculated Property |
| η | 0.0004265 | Pa×s | 332.93 | Calculated Property |
| η | 0.0003944 | Pa×s | 352.20 | Calculated Property |
| η | 0.0003677 | Pa×s | 371.48 | Calculated Property |
Similar Compounds
Find more compounds similar to Oxirane, (chloromethyl)-.
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
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