- 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
- 106-89-8
- 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
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ΔcH°liquid | [-1770.00; -1235.80] | kJ/mol |
|
| ΔcH°liquid | -1770.00 ± 0.40 | kJ/mol | NIST |
| ΔcH°liquid | -1761.64 ± 0.77 | kJ/mol | NIST |
| ΔcH°liquid | -1235.80 ± 0.85 | kJ/mol | NIST |
| ΔfH°gas | -108.00 ± 4.20 | kJ/mol | NIST |
| ΔfH°liquid | -149.00 ± 0.40 | kJ/mol | NIST |
| ΔfusH° | 13.84 | kJ/mol | Joback Calculated Property |
| IE | [10.60; 10.66] | eV |
|
| IE | 10.66 | eV | NIST |
| IE | 10.60 | eV | NIST |
| IE | 10.64 | eV | NIST |
| IE | 10.64 | eV | NIST |
| logPoct/wat | 0.624 | Crippen Calculated Property | |
| McVol | 60.380 | ml/mol | McGowan Calculated Property |
| Inp | [695.00; 730.00] |
|
|
| Inp | 700.00 | NIST | |
| Inp | 720.00 | NIST | |
| Inp | 708.00 | NIST | |
| Inp | 730.00 | NIST | |
| Inp | 695.00 | NIST | |
| Inp | 708.00 | NIST | |
| Inp | 695.00 | NIST | |
| Inp | 720.00 | NIST | |
| Inp | 700.00 | NIST | |
| Inp | 730.00 | NIST | |
| I | [1169.00; 1205.00] |
|
|
| I | 1169.00 | NIST | |
| I | 1169.00 | NIST | |
| I | 1205.00 | NIST | |
| Tboil | [388.35; 390.00] | K |
|
| Tboil | 389.20 | K | NIST |
| Tboil | 390.00 ± 2.00 | K | NIST |
| Tboil | 388.35 | K | NIST |
| Tboil | 389.60 ± 0.70 | K | NIST |
| Tfus | 215.05 | K | NIST |
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 | [93.33; 130.93] | J/mol×K | [339.36; 530.68] |
|
| Cp,gas | 93.33 | J/mol×K | 339.36 | Joback Calculated Property |
| Cp,gas | 100.67 | J/mol×K | 371.25 | Joback Calculated Property |
| Cp,gas | 107.55 | J/mol×K | 403.13 | Joback Calculated Property |
| Cp,gas | 114.00 | J/mol×K | 435.02 | Joback Calculated Property |
| Cp,gas | 120.03 | J/mol×K | 466.91 | Joback Calculated Property |
| Cp,gas | 125.66 | J/mol×K | 498.79 | Joback Calculated Property |
| Cp,gas | 130.93 | J/mol×K | 530.68 | Joback Calculated Property |
| η | [0.0004151; 0.0011282] | Pa×s | [198.00; 339.36] |
|
| η | 0.0011282 | Pa×s | 198.00 | Joback Calculated Property |
| η | 0.0008740 | Pa×s | 221.56 | Joback Calculated Property |
| η | 0.0007112 | Pa×s | 245.12 | Joback Calculated Property |
| η | 0.0006000 | Pa×s | 268.68 | Joback Calculated Property |
| η | 0.0005202 | Pa×s | 292.24 | Joback Calculated Property |
| η | 0.0004608 | Pa×s | 315.80 | Joback Calculated Property |
| η | 0.0004151 | Pa×s | 339.36 | Joback Calculated Property |
| ΔvapH | [41.00; 42.90] | kJ/mol | [293.00; 323.50] |
|
| ΔvapH | 41.00 ± 4.20 | kJ/mol | 293.00 | NIST |
| ΔvapH | 42.90 | kJ/mol | 323.50 | NIST |
Similar Compounds
Find more compounds similar to Oxirane, (chloromethyl)-.
Sources
- 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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