- InChI
- InChI=1S/C7H13ClO/c1-4-5-7(2,3)6(8)9/h4-5H2,1-3H3
- InChI Key
- NUBKYCCXDNYHLQ-UHFFFAOYSA-N
- Formula
- C7H13ClO
- SMILES
- CCCC(C)(C)C(=O)Cl
- Molecular Weight1
- 148.63
- CAS
- 15721-22-9
- Other Names
-
- Pentanoyl chloride, 2,2-dimethyl-
- 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).
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | -129.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -324.88 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.01 | kJ/mol | Joback Calculated Property |
| log10WS | -2.44 | Crippen Calculated Property | |
| logPoct/wat | 2.578 | Crippen Calculated Property | |
| McVol | 123.300 | ml/mol | McGowan Calculated Property |
| Pc | 2937.70 | kPa | Joback Calculated Property |
| Tboil | 447.63 | K | Joback Calculated Property |
| Tc | 642.91 | K | Joback Calculated Property |
| Tfus | 250.92 | K | Joback Calculated Property |
| Vc | 0.471 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [245.14; 308.55] | J/mol×K | [447.63; 642.91] | 
|
| Cp,gas | 245.14 | J/mol×K | 447.63 | Joback Calculated Property |
| Cp,gas | 257.32 | J/mol×K | 480.18 | Joback Calculated Property |
| Cp,gas | 268.82 | J/mol×K | 512.72 | Joback Calculated Property |
| Cp,gas | 279.66 | J/mol×K | 545.27 | Joback Calculated Property |
| Cp,gas | 289.87 | J/mol×K | 577.82 | Joback Calculated Property |
| Cp,gas | 299.49 | J/mol×K | 610.36 | Joback Calculated Property |
| Cp,gas | 308.55 | J/mol×K | 642.91 | Joback Calculated Property |
| η | [0.0003435; 0.0059406] | Pa×s | [250.92; 447.63] |
|
| η | 0.0059406 | Pa×s | 250.92 | Joback Calculated Property |
| η | 0.0028073 | Pa×s | 283.71 | Joback Calculated Property |
| η | 0.0015495 | Pa×s | 316.49 | Joback Calculated Property |
| η | 0.0009562 | Pa×s | 349.27 | Joback Calculated Property |
| η | 0.0006410 | Pa×s | 382.06 | Joback Calculated Property |
| η | 0.0004578 | Pa×s | 414.85 | Joback Calculated Property |
| η | 0.0003435 | Pa×s | 447.63 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 333.50 ± 0.50 | K | 4.00 | NIST |
Similar Compounds
Find more compounds similar to 2,2-Dimethylvaleroyl chloride.
Sources
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