- InChI
- InChI=1S/C4H7ClO2/c5-3-1-2-4(6)7/h1-3H2,(H,6,7)
- InChI Key
- IPLKGJHGWCVSOG-UHFFFAOYSA-N
- Formula
- C4H7ClO2
- SMILES
- O=C(O)CCCCl
- Molecular Weight1
- 122.55
- CAS
- 627-00-9
- Other Names
-
- Butyric acid, 4-chloro-
- «gamma»-Chlorobutyric acid
- Gammachlorobutyric acid
- 4-Chlorobutanoic acid
- 4-Chlorobutyric acid
- Cl(CH2)3COOH
- «gamma»-Chloro-n-butyric acid
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- Inp : Non-polar retention indices.
- 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 |
|---|---|---|---|
| ΔcH°liquid | [-2031.80; -2028.00] | kJ/mol |
|
| ΔcH°liquid | -2031.80 ± 8.40 | kJ/mol | NIST |
| ΔcH°liquid | -2028.00 | kJ/mol | NIST |
| ΔfG° | -294.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -406.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.31 | kJ/mol | Joback Calculated Property |
| log10WS | -0.75 | Crippen Calculated Property | |
| logPoct/wat | 1.090 | Crippen Calculated Property | |
| McVol | 86.900 | ml/mol | McGowan Calculated Property |
| Pc | 4540.80 | kPa | Joback Calculated Property |
| Inp | 1063.10 | NIST | |
| Tboil | 474.40 | K | Joback Calculated Property |
| Tc | 654.46 | K | Joback Calculated Property |
| Tfus | 275.51 | K | Joback Calculated Property |
| Vc | 0.334 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [167.03; 200.53] | J/mol×K | [474.40; 654.46] |
|
| Cp,gas | 167.03 | J/mol×K | 474.40 | Joback Calculated Property |
| Cp,gas | 173.29 | J/mol×K | 504.41 | Joback Calculated Property |
| Cp,gas | 179.27 | J/mol×K | 534.42 | Joback Calculated Property |
| Cp,gas | 184.98 | J/mol×K | 564.43 | Joback Calculated Property |
| Cp,gas | 190.42 | J/mol×K | 594.44 | Joback Calculated Property |
| Cp,gas | 195.60 | J/mol×K | 624.45 | Joback Calculated Property |
| Cp,gas | 200.53 | J/mol×K | 654.46 | Joback Calculated Property |
| η | [0.0002591; 0.0190491] | Pa×s | [275.51; 474.40] |
|
| η | 0.0190491 | Pa×s | 275.51 | Joback Calculated Property |
| η | 0.0063353 | Pa×s | 308.66 | Joback Calculated Property |
| η | 0.0026085 | Pa×s | 341.81 | Joback Calculated Property |
| η | 0.0012565 | Pa×s | 374.95 | Joback Calculated Property |
| η | 0.0006815 | Pa×s | 408.10 | Joback Calculated Property |
| η | 0.0004052 | Pa×s | 441.25 | Joback Calculated Property |
| η | 0.0002591 | Pa×s | 474.40 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 469.20 | K | 2.90 | NIST |
Similar Compounds
Find more compounds similar to Butanoic acid, 4-chloro-.
Sources
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