- InChI
- InChI=1S/C4H7ClO/c1-3(2)4(5)6/h3H,1-2H3
- InChI Key
- DGMOBVGABMBZSB-UHFFFAOYSA-N
- Formula
- C4H7ClO
- SMILES
- CC(C)C(=O)Cl
- Molecular Weight1
- 106.55
- CAS
- 79-30-1
- Other Names
-
- 2-Methylpropanoyl chloride
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase 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).
- 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° | -160.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -259.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 35.24 | kJ/mol | Joback Calculated Property |
| log10WS | -1.18 | Crippen Calculated Property | |
| logPoct/wat | 1.408 | Crippen Calculated Property | |
| McVol | 81.030 | ml/mol | McGowan Calculated Property |
| Pc | 4067.32 | kPa | Joback Calculated Property |
| Inp | [672.00; 672.00] |
|
|
| Inp | 672.00 | NIST | |
| Inp | 672.00 | NIST | |
| Inp | 672.00 | NIST | |
| Tboil | [333.00; 365.20] | K |
|
| Tboil | 365.20 | K | NIST |
| Tboil | 363.00 ± 3.00 | K | NIST |
| Tboil | 333.00 ± 4.00 | K | NIST |
| Tboil | 365.00 ± 2.00 | K | NIST |
| Tc | 573.96 | K | Joback Calculated Property |
| Tfus | 183.20 ± 0.70 | K | NIST |
| Vc | 0.308 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [131.55; 170.67] | J/mol×K | [381.78; 573.96] |
|
| Cp,gas | 131.55 | J/mol×K | 381.78 | Joback Calculated Property |
| Cp,gas | 138.84 | J/mol×K | 413.81 | Joback Calculated Property |
| Cp,gas | 145.81 | J/mol×K | 445.84 | Joback Calculated Property |
| Cp,gas | 152.47 | J/mol×K | 477.87 | Joback Calculated Property |
| Cp,gas | 158.83 | J/mol×K | 509.90 | Joback Calculated Property |
| Cp,gas | 164.89 | J/mol×K | 541.93 | Joback Calculated Property |
| Cp,gas | 170.67 | J/mol×K | 573.96 | Joback Calculated Property |
| Cp,liquid | 131.80 | J/mol×K | 298.00 | NIST |
| η | [0.0003505; 0.0053672] | Pa×s | [199.69; 381.78] |
|
| η | 0.0053672 | Pa×s | 199.69 | Joback Calculated Property |
| η | 0.0025233 | Pa×s | 230.04 | Joback Calculated Property |
| η | 0.0014145 | Pa×s | 260.39 | Joback Calculated Property |
| η | 0.0008947 | Pa×s | 290.74 | Joback Calculated Property |
| η | 0.0006172 | Pa×s | 321.08 | Joback Calculated Property |
| η | 0.0004539 | Pa×s | 351.43 | Joback Calculated Property |
| η | 0.0003505 | Pa×s | 381.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to isobutyryl chloride.
Sources
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