- InChI
- InChI=1S/C6H11ClO2/c1-2-3-4-6(8)9-5-7/h2-5H2,1H3
- InChI Key
- ZYDSTVMBNBPPLQ-UHFFFAOYSA-N
- Formula
- C6H11ClO2
- SMILES
- CCCCC(=O)OCCl
- Molecular Weight1
- 150.60
- CAS
- 77877-94-2
- Other Names
-
- Pentanoic acid, chloromethyl ester
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- Inp : Non-polar retention indices.
- I : 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 |
|---|---|---|---|
| ω | 0.4875 | Relay (1.0) Calculated Property | |
| ΔfG° | -322.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -519.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.46 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.06 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.916 | Crippen Calculated Property | |
| McVol | 115.080 | ml/mol | McGowan Calculated Property |
| Pc | 2999.15 | kPa | Joback Calculated Property |
| Inp | [953.00; 997.00] |
|
|
| Inp | 989.00 | NIST | |
| Inp | 967.00 | NIST | |
| Inp | 953.00 | NIST | |
| Inp | 997.00 | NIST | |
| I | [1374.00; 1417.00] |
|
|
| I | 1374.00 | NIST | |
| I | 1374.00 | NIST | |
| I | 1376.00 | NIST | |
| I | 1396.00 | NIST | |
| I | 1417.00 | NIST | |
| Tboil | 440.67 | K | Relay (1.0) Calculated Property |
| Tc | 629.69 | K | Relay (1.0) Calculated Property |
| Tfus | 202.53 | K | Relay (1.0) Calculated Property |
| Vc | 0.429 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [221.42; 275.13] | J/mol×K | [432.53; 613.42] |
|
| Cp,gas | 221.42 | J/mol×K | 432.53 | Joback Calculated Property |
| Cp,gas | 231.32 | J/mol×K | 462.68 | Joback Calculated Property |
| Cp,gas | 240.85 | J/mol×K | 492.83 | Joback Calculated Property |
| Cp,gas | 249.99 | J/mol×K | 522.97 | Joback Calculated Property |
| Cp,gas | 258.75 | J/mol×K | 553.12 | Joback Calculated Property |
| Cp,gas | 267.13 | J/mol×K | 583.27 | Joback Calculated Property |
| Cp,gas | 275.13 | J/mol×K | 613.42 | Joback Calculated Property |
| η | [0.0002855; 0.0053702] | Pa×s | [229.63; 432.53] |
|
| η | 0.0053702 | Pa×s | 229.63 | Joback Calculated Property |
| η | 0.0024059 | Pa×s | 263.45 | Joback Calculated Property |
| η | 0.0012939 | Pa×s | 297.26 | Joback Calculated Property |
| η | 0.0007898 | Pa×s | 331.08 | Joback Calculated Property |
| η | 0.0005283 | Pa×s | 364.90 | Joback Calculated Property |
| η | 0.0003784 | Pa×s | 398.71 | Joback Calculated Property |
| η | 0.0002855 | Pa×s | 432.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Chloromethyl pentanoate.
Sources
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